"Coformycin","C11H16N4O5","C01677","4820"
"2-Oxo-5-methyl-cis-muconate","C7H8O5","C07479","9682"
"2-Hydroxy-5-methyl-cis,cis-muconate","C7H8O5","C07478","9681"
"Candesartan","C24H20N6O3","C07468","9671"
"Eprosartan","C23H24N2O4S","C07467","9670"
"Dihydroxymandelic acid","C8H8O5","C07470","9673"
"Irbesartan","C25H28N6O","C07469","9672"
"Muscarine","C9H20NO2+","C07473","9676"
"Methacholine","C8H18NO2+","C07471","9674"
"Lobeline","C22H27NO2","C07475","9678"
"Pilocarpine","C11H16N2O2","C07474","9677"
"5-Nitro-2-(3-phenylpropylamino)benzoic acid","C16H16N2O4","C13705","586294"
"TS-TM-calix(4)arene","C32H32O16S4","C13704","586293"
"Fenamic acid","C13H11NO2","C13697","586286"
"(+)-TACP","C6H11NO2","C13696","586285"
"9-Anthroic acid","C15H10O2","C13699","586288"
"Niflumic acid","C13H9F3N2O2","C13698","586287"
"CPP","C9H9ClO3","C13701","586290"
"Clofibric acid","C10H11ClO3","C13700","586289"
"IAA-94","C17H18Cl2O4","C13703","586292"
"4-Acetamido-4'-isothiocyanostilbene-2,2'-disulphonic acid","C17H14N2O7S3","C13702","586291"
"Lipoxin A4","C20H32O5","C06314","8550"
"Lipoxin B4","C20H32O5","C06315","8551"
"Choline sulfate","C5H13NO4S","C00919","4173"
"(+)-alpha-Pinene","C10H16","C06306","8542"
"(-)-beta-Pinene","C10H16","C06307","8543"
"(-)-alpha-Pinene","C10H16","C06308","8544"
"Diplopterol","C30H52O","C06309","8545"
"Diploptene","C30H50","C06310","8546"
"Galactitol 1-phosphate","C6H15O9P","C06311","8547"
"L-Tagatose 6-phosphate","C6H13O9P","C06312","8548"
"Biopterin","C9H11N5O3","C06313","8549"
"Isometamidium chloride","C28H26ClN7","C11201","13382"
"Lenacil","C13H18N2O2","C11200","13381"
"Cefpirome","C22H22N6O5S2","C11199","13380"
"Melitten","C131H229N39O31","C11198","13379"
"Spiperone","C23H26FN3O2","C11197","13378"
"Methomyl","C5H10N2O2S","C11196","13377"
"Mitoxantrone","C22H28N4O6","C11195","13376"
"Morfamquat","C26H36Cl2N4O4","C11194","13375"
"Cefozopran","C19H17N9O5S2","C11203","13384"
"Cefclidin","C21H26N8O6S2","C11202","13383"
"trans-4-Hydroxycyclohexylacetic acid","C8H14O3","","285536"
"Biguanide","C2H7N5","C07672","9874"
"Histrelin","C66H86N18O12","C07671","9873"
"Sulfolithocholic acid","C24H40O6S","","692134"
"Apraclonidine","C9H10Cl2N4","C07668","9870"
"Gossypol","C30H30O8","C07667","9869"
"Repaglinide","C27H36N2O4","C07670","9872"
"Glimepiride","C24H34N4O5S","C07669","9871"
"Trovafloxacin","C20H15F3N4O3","C07664","9866"
"Moxifloxacin","C21H24FN3O4","C07663","9865"
"Dapsone","C12H12N2O2S","C07666","9868"
"Ethionamide","C8H10N2S","C07665","9867"
"ML-236C","C18H26O3","C14043","7846935"
"1-Nitronaphthalene","C10H7NO2","C14040","7846934"
"Aspoxicillin","C21H27N5O7S","C13269","586013"
"Glucuronolactone","C6H8O6","C13268","586012"
"Meglumine","C7H17NO5","C13264","586008"
"Diphenhydramine salicylate","C24H27NO4","C14015","854256"
"Glyclopyramide","C11H14ClN3O3S","C13267","586011"
"Iopamidol","C17H22I3N3O8","C13265","586009"
"Mebhydrolin napadisilate","C48H48N4O6S2","C13254","585998"
"Piperacillin","C23H27N5O7S","C14034","854275"
"beta-D-Glucopyranuronamide","C6H11NO6","C13259","586003"
"Sultiame","C10H14N2O4S2","C13255","585999"
"Valproic acid glucuronide","C14H24O8","","664921"
"Vinylacetylglycine","C7H11NO3","",""
"Dibenzylsuccinate","C18H18O4","C07332","9540"
"2-Hydroxy-4-isopropenylcyclohexane-1-carboxyl-CoA","C31H50N7O18P3S","C11934","14095"
"4-Isopropenyl-2-oxy-cyclohexanecarboxyl-CoA","C31H48N7O18P3S","C11935","14096"
"dTDP-4-oxo-6-deoxy-D-allose","C16H24N2O15P2","C11926","14087"
"dTDP-4-oxo-2,6-dideoxy-L-mannose","C16H24N2O14P2","C11927","14088"
"dTDP-4-oxo-2,6-dideoxy-D-allose","C16H24N2O14P2","C11928","14089"
"Perillyl-CoA","C31H48N7O17P3S","C11929","14090"
"dTDP 1-ester with (6R)-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran","C16H22N2O14P2","C11930","14091"
"dTDP 1-ester with (6S)-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran","C16H22N2O14P2","C11931","14092"
"dTDP 1-ester with 2,6-dideoxy-L-erythro-hexopyranos-3-ulose","C16H24N2O14P2","C11932","14093"
"dTDP-D-mycaminose","C18H31N3O14P2","C11933","14094"
"N-Butyrylglycine","C6H11NO3","","665216"
"Dimethylprotoporphyrin IX","C36H38N4O4","","395298"
"Pentacarboxyporphyrin","C37H38N4O10","","746273"
"N-Palmitoylsphingosine","C34H67NO3","",""
"Monoiodothyronine","C15H14INO4","","3886537"
"Pristanic acid","C19H38O2","","700681"
"SAICAR","C13H19N4O12P","","841721"
"Oenanthic ether","C9H18O2","","291184"
"N-Acetyl-b-neuraminic acid","C11H19NO9","",""
"Phosphatidyl ethanolamine","C40H80NO8P","","160700"
"Jasmone","C11H16O","C08490","10683"
"(-)-Jasmonic acid","C12H18O3","C08491","10684"
"Giganin","C35H62O6","C08488","10681"
"(Z)-3,5-Hexadienyl butyrate","C10H16O2","C08489","10682"
"Ethyl(E,Z)-decadienoate","C12H20O2","C08486","10679"
"Ethyl 2-methylbut-2-enoate","C7H12O2","C08487","10680"
"Epoxymurin-A","C35H62O3","C08484","10677"
"2-(4-Methoxyphenethyl)chromone","C18H16O3","C08485","10678"
"Leaf alcohol","C6H12O","C08492","10685"
"Indole-3-carboxaldehyde","C9H7NO","C08493","10686"
"Benzylsuccinate","C11H12O4","C09816","12004"
"Benzamide","C7H7NO","C09815","12003"
"Benzonitrile","C7H5N","C09814","12002"
"2-Ketocyclohexane-1-carboxyl-CoA","C28H44N7O18P3S","C09813","12001"
"2-Hydroxycyclohexane-1-carboxyl-CoA","C28H46N7O18P3S","C09812","12000"
"Cyclohex-1-ene-1-carboxyl-CoA","C28H44N7O17P3S","C09811","11999"
"Cyclohex-1,4-diene-1-carboxyl-CoA","C28H42N7O17P3S","C09810","11998"
"Cyclohex-2,5-diene-1-carboxyl-CoA","C28H42N7O17P3S","C09809","11997"
"E-Phenylitaconyl-CoA","C32H44N7O19P3S","C09818","12006"
"Benzylsuccinyl-CoA","C32H46N7O19P3S","C09817","12005"
"2-oxo-5-methylthiopentanoic-acid","C6H10O3S","",""
"(-)-(1S)-sabinene","C10H16","","161801"
"UBIQUINOL-8","C49H78O4","","3244"
"18-hydroxyoleate","C18H34O3","","3729003"
"2,5-diamino-6-(ribosylamino)-4-(3H)-pyrimidinone 5'-phosphate","C9H16N5O8P","",""
"Indole-3-acetyl-L-alanine","C13H14N2O3","","841896"
"homomethionine","C6H13NO2S","","1078"
"Diethyl sulfide","C4H10S","C02272","5332"
"Alditol 6-phosphate","C6H15O9P","C02810","5760"
"Albendazole S-oxide","C12H15N3O3S","C02809","5759"
"Ubiquinone-9","C54H82O4","C01967","5068"
"Trimethoprim","C14H18N4O3","C01965","5066"
"8-Hydroxykaempferol","C15H10O7","C02806","5756"
"Tolylacetate","C9H10O2","C01963","5064"
"Thiocysteine","C3H7NO2S2","C01962","5063"
"Thalassemine","C8H19N4O6P","C01961","5062"
"Taurocyamine","C3H9N3O3S","C01959","5060"
"4,5-Dioxopentanoate","C5H6O4","C02800","5750"
"Pyrazinamide","C5H5N3O","C01956","5057"
"4-Fluorobenzoyl-CoA","C28H39FN7O17P3S","C02802","5752"
"2-(4'-Chlorophenyl)-3,3-dichloropropenoate","C9H5Cl3O2","C06646","8872"
"Isohelenol","C15H18O5","C09485","11676"
"Isoalantolactone","C15H20O2","C09484","11675"
"Hydroxyvernolide","C19H22O8","C09477","11668"
"7alpha-Hydroxydehydrocostus lactone","C15H18O3","C09476","11667"
"Betagarin","C18H16O6","C09479","11670"
"Auriculoside","C22H26O10","C09478","11669"
"Hymenolin","C15H20O4","C09481","11672"
"Hymenoflorin","C15H20O5","C09480","11671"
"Inulicin","C17H24O5","C09483","11674"
"Hymenoxon","C15H22O5","C09482","11673"
"Tylophorine","C24H27NO4","C10623","12806"
"Verruculotoxin","C15H20N2O","C10624","12807"
"Sirodesmin H","C20H26N2O8S","C10617","12800"
"Sporidesmin","C18H20ClN3O6S2","C10618","12801"
"Shihunine","C12H13NO2","C10615","12798"
"(+)-Galbacin","C20H20O5","C10616","12799"
"Gomisin L1 methyl ether","C23H28O6","C10621","12804"
"Grandisin","C24H32O7","C10622","12805"
"Taxine A","C35H47NO10","C10619","12802"
"(-)-Tylocrebrine","C24H27NO4","C10620","12803"
"Echitamine","C22H29N2O4+","C09152","11344"
"12-O-Palmitoyl-16-hydroxyphorbol 13-acetate","C38H60O9","C09153","11345"
"D-Glucosylsphingosine","C24H47NO7","C03108","6004"
"D-Glucono-1,4-lactone","C6H10O6","C03107","6003"
"7-Hydroxycholest-4-en-3-one","C27H44O2","C03775","6528"
"Aromatic hydroxy acid","C7H6O2","C03096","5994"
"7,8-Dihydroxycoumarin","C9H6O4","C03093","5991"
"6-endo-Hydroxycineole","C10H18O2","C03092","5990"
"Calanolide A","C22H26O5","C09147","11339"
"Cytidine 2'-phosphate","C9H14N3O8P","C03104","6000"
"Cyclobutadipyrimidine","C18H34N4O12P2","C03103","5999"
"17-Oxogrindelic acid","C20H30O4","C09150","11342"
"Palmarin","C20H22O7","C09151","11343"
"Bis-4-nitrophenyl phosphate","C12H9N2O8P","C03779","6530"
"Plenolin","C15H20O4","C09531","11722"
"4-Hydroxyphenylacetonitrile","C8H7NO","C03766","6522"
"3-Hydroxy-3-methyl-2-oxopentanoic acid","C6H10O4","C04237","6906"
"5-Fluorodeoxyuridine monophosphate","C9H12FN2O8P","C04242","6908"
"2-Carboxy-D-arabinitol 1-phosphate","C6H13O10P","C04234","6903"
"(2S)-2-Isopropyl-3-oxosuccinate","C7H10O5","C04236","6905"
"N-Acetyl-D-galactosamine 6-sulfate","C8H15NO9S","C04255","6920"
"N-Acetyl-D-glucosamine 1-phosphate","C8H16NO9P","C04256","6921"
"6-Lactoyl-5,6,7,8-tetrahydropterin","C9H13N5O3","C04244","6909"
"Amino acid(Tyr-, Trp-, Phe-, Leu-)","C35H47N5O9","C04245","6910"
"Gentisin","C14H10O5","C10066","12252"
"Gentisein","C13H8O5","C10065","12251"
"6-Hydroxykaempferol","C15H10O7","C10068","12254"
"Irisxanthone","C20H20O11","C10067","12253"
"Gambogic acid","C38H44O8","C10062","12248"
"Euxanthone","C13H8O4","C10061","12247"
"Gentiacaulein","C15H12O6","C10064","12250"
"Gartanin","C23H24O6","C10063","12249"
"Cuscohygrine","C13H24N2O","C06521","8752"
"(S)-Norreticuline","C18H21NO4","C06520","8751"
"(S)-3'-Hydroxycoclaurine","C17H19NO4","C06519","8750"
"(S)-Nororientaline","C18H21NO4","C06518","8749"
"Gentianine","C10H9NO2","C06525","8756"
"Nornicotine","C9H12N2","C06524","8755"
"Coniine","C8H17N","C06523","8754"
"Strychnine","C21H22N2O2","C06522","8753"
"Cyclovirobuxine C","C27H48N2O","C10801","12984"
"5-(Heptadec-12-enyl)resorcinol","C23H38O2","C10802","12985"
"Quinidine","C20H24N2O2","C06527","8758"
"Quinine","C20H24N2O2","C06526","8757"
"Cyclobuxine D","C25H42N2O","C10797","12980"
"Cyclopamine","C27H41NO2","C10798","12981"
"Buxamine E","C26H44N2","C10795","12978"
"alpha-Chaconine","C45H73NO14","C10796","12979"
"1,3-Dimethyl-6,8-isoquinolinediol","C11H11NO2","C12345","582735"
"1,8-Dihydroxy-3-methylnaphthalene","C11H10O2","C12344","582734"
"Deoxyribose triphosphate","C5H13O13P3","C12347","582737"
"1,3-Dimethyl-8-isoquinolinol","C11H11NO","C12346","582736"
"Dioncophyllinol B","C23H25NO4","C12341","582731"
"Ancistrotectorine","C26H31NO4","C12340","582730"
"Isoshinanolone","C11H12O3","C12343","582733"
"Ancistrobrevine A","C27H33NO4","C12342","582732"
"Tetracenomycin F1","C20H14O7","C12367","582757"
"Tetracenomycin F2","C20H16O8","C12366","582756"
"3-(Pyrazol-1-yl)-L-alanine","C6H9N3O2","C01162","4389"
"Crotono-betaine","C8H16NO+","C11458","13629"
"3-(3-Hydroxy-phenyl)-propanoic acid","C9H10O3","C11457","13628"
"3,4-Dihydroxyphenylacetate","C8H8O4","C01161","4388"
"2-C-Methyl-D-erythritol 2,4-cyclodiphosphate","C5H12O9P2","C11453","13625"
"dTDP-4-oxo-alpha-L-rhamnose","C16H24N2O15P2","C11452","13624"
"cis-3-(1-Carboxy-ethyl)-3,5-cyclo-hexadiene-1,2-diol","C9H12O4","C11456","13627"
"4,4-Dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol","C29H46O","C11455","13626"
"Benzoxazolinyl-CoA","C32H43N8O20P3S","C11448","13620"
"dTDP-4-dimethylamino-4,6-dideoxy-5-C-methyl-L-mannose","C19H33N3O14P2","C11447","13619"
"dTDP-alpha-D-glucose","C16H26N2O16P2","C11451","13623"
"6-Deoxy-D-glucose","C6H12O5","C02522","5532"
"3-Carboxy-cis,cis-muconate","C7H6O6","C01163","4390"
"Americine","C31H39N5O4","C09996","12182"
"trans-4-Hydroxy-L-proline","C5H9NO3","C01157","4385"
"Quercetin 3,4'-bissulfate","C15H10O13S2","C01156","4384"
"2,3-Bisphospho-D-glycerate","C3H8O10P2","C01159","4387"
"1-O-Galloyl-beta-D-glucose","C13H16O10","C01158","4386"
"Deutzioside","C15H22O9","C11671","13836"
"Iridodial glucoside","C16H26O7","C11670","13835"
"Geniposidic acid","C16H22O10","C11673","13838"
"10-Deoxygeniposidic acid","C16H22O9","C11672","13837"
"16-Methoxytabersonine","C22H26N2O3","C11675","13840"
"Secogalioside","C17H24O12","C11674","13839"
"Horhammericine","C21H24N2O4","C11677","13842"
"Lochnericine","C21H24N2O3","C11676","13841"
"4,21-Dehydrocorynantheine aldehyde","C21H23N2O3+","C11679","13844"
"Dialdehyde","C21H24N2O4","C11678","13843"
"AMP","C10H14N5O7P","C00020","3322"
"Butylate","C11H23NOS","C14323","159449"
"Chlorpyrifos","C9H11Cl3NO3PS","C14322","161106"
"2,5-Dichloro-cis,cis-muconate","C6H4Cl2O4","C07095","9306"
"2,6-Dichlorophenol","C6H4Cl2O","C07096","9307"
"Heptachlor epoxide","C10H5Cl7O","C14327","157249"
"Dimethoate","C5H12NO3PS2","C14326","148953"
"Dibenz[a,h]anthracene","C22H14","C14325","148691"
"Diazinon","C12H21N2O3PS","C14324","152741"
"5-Chloro-2-hydroxymuconic semialdehyde","C6H5ClO4","C07089","9300"
"Protoanemonin","C5H4O2","C07090","9301"
"2-Hydroxy-6-oxoocta-2,4,7-trienoate","C8H8O4","C07087","9298"
"4-Chlorophenoxyacetate","C8H7ClO3","C07088","9299"
"3,6-Dichloro-cis-1,2-dihydroxycyclohexa-3,5-diene","C6H6Cl2O2","C07093","9304"
"3,6-Dichlorocatechol","C6H4Cl2O2","C07094","9305"
"cis-Acetylacrylate","C5H6O3","C07091","9302"
"1,4-Dichlorobenzene","C6H4Cl2","C07092","9303"
"Di-n-propylphthalate","C14H18O4","C14469","151714"
"Diisopropyl phthalate","C14H18O4","C14468","155110"
"cis-1,2-Diphenylcyclobutane","C16H16","C14467",""
"4-n-Pentylphenol","C11H16O","C14466","169640"
"4-n-Hexylphenol","C12H18O","C14465","160326"
"4-n-Butylphenol","C10H14O","C14464","158741"
"(R)-3-Hydroxy-3-methyl-2-oxopentanoate","C6H10O4","C14463",""
"3,4-Dichlorophenol","C6H4Cl2O","C14462","150309"
"4-Hydroxy-2,2',4',5,5'-pentachlorobiphenyl","C12H5Cl5O","C14471","3746427"
"3-Methylcholanthrene","C21H16","C14470","148779"
"Pimobendan","C19H18N4O2","C12532","582922"
"Epristeride","C25H37NO3","C12533","582923"
"Efloxate","C19H16O5","C12534","582924"
"Tranexamic acid","C8H15NO2","C12535","582925"
"Ramatroban","C21H21FN2O4S","C12527","582917"
"Doramectin","C50H74O14","C12528","582918"
"Lafutidine","C22H29N3O4S","C12530","582920"
"Tazarotene","C21H21NO2S","C12531","582921"
"Benzyl benzoate","C14H12O2","C12537","582927"
"Sulfamonomethoxine","C11H12N4O3S","C12540","582930"
"Diatrizoic acid","C11H9I3N2O4","C14020","854261"
"1,3,5-Trimethoxybenzene","C9H12O3","C13260","586004"
"Desacetyleupaserrin","C20H26O6","C09395","11586"
"Cefoselis sulfate","C19H24N8O10S3","C14011","854252"
"Desacetoxymatricarin","C15H18O3","C09394","11585"
"Sodium cloxacillin monohydrate","C19H19ClN3NaO6S","C14010","854251"
"1,1-Dichloroethylene","C2H2Cl2","C14039","7846933"
"Carmofur","C11H16FN3O3","C13252","585996"
"Kazinol A","C25H30O4","C09760","11948"
"Trimipramine maleate","C24H30N2O4","C14029","854270"
"Ticarcillin disodium","C15H14N2Na2O6S2","C14021","854262"
"alpha,alpha'-Trehalose 6,6'-bismycolate","C76H142O15","C04465","7088"
"Radiatin","C19H24O6","C09539","11730"
"(+)-cis-3,4-Dihydrophenanthrene-3,4-diol","C14H12O2","C04468","7091"
"Methylglyoxal","C3H4O2","C00546","3827"
"Borneol","C10H18O","C01411","4599"
"Phenyl acetate","C8H8O2","C00548","3829"
"Casbene","C20H32","C01414","4602"
"(+)-Neomenthol","C10H20O","C00553","3834"
"meso-Tartaric acid","C4H6O6","C00552","3833"
"Benzyl alcohol","C7H8O","C00556","3836"
"4-Aminobutanal","C4H9NO","C00555","3835"
"D-Tagaturonate","C6H10O7","C00558","3838"
"Cyclopentanone","C5H8O","C00557","3837"
"N-Acetyllactosamine","C14H25NO11","C00611","3885"
"3-Sulfino-L-alanine","C3H7NO4S","C00606","3881"
"Cycasin","C8H16N2O7","C01418","4605"
"Cyanate","CHNO","C01417","4604"
"Aconifine","C34H47NO12","C08655","10848"
"Acetylbrowniine","C27H43NO8","C08654","10847"
"Anhwiedelphinine","C35H44N2O10","C08657","10850"
"Ajaconine","C22H33NO3","C08656","10849"
"Anthranoyllycoctonine","C32H46N2O8","C08659","10852"
"Anopterine","C31H43NO7","C08658","10851"
"Avadharidine","C36H51N3O10","C08661","10854"
"Atisine","C22H33NO2","C08660","10853"
"Beiwutine","C32H43NO12","C08663","10856"
"Barbinine","C36H46N2O10","C08662","10855"
"Flaccidin B","C41H64O12","C08943","11135"
"Echinocystic acid","C30H48O4","C08942","11134"
"5-Hydroxyeicosatetraenoate","C20H32O3","C04805","7367"
"2-(alpha-Hydroxyethyl)thiamine diphosphate","C14H23N4O8P2S+","C05125","7546"
"2-Hydroxyethanesulfonate","C2H6O4S","C05123","7545"
"17alpha-(N-Acetyl-D-glucosaminyl)-estradiol 3-D-glucuronoside","C32H45NO13","C04806","7368"
"Methostenol","C28H48O","C05111","7537"
"4alpha-Methylcholesta-8-en-3beta-ol","C28H48O","C05110","7536"
"3-Hydroxybutanoyl-CoA","C25H42N7O18P3S","C05116","7540"
"Porphyrin","C20H14N4","C05113","7538"
"S-(2-Methylbutanoyl)-dihydrolipoamide","C13H25NO2S2","C05118","7542"
"3-Aminobutanoyl-CoA","C25H43N8O17P3S","C05117","7541"
"Taurocholate","C26H45NO7S","C05122","7544"
"S-(3-Methylbutanoyl)-dihydrolipoamide","C13H25NO2S2","C05119","7543"
"Aspidinol","C12H16O4","C10673","12856"
"2-Hydroxybutanoic acid","C4H8O3","C05984","8262"
"Dithioerythritol","C4H10O2S2","C00950","4201"
"Adenosine 2'-phosphate","C10H14N5O7P","C00946","4197"
"3-Dehydroquinate","C7H10O6","C00944","4196"
"3',5'-Cyclic IMP","C10H11N4O7P","C00943","4195"
"3',5'-Cyclic GMP","C10H12N5O7P","C00942","4194"
"3',5'-Cyclic CMP","C9H12N3O7P","C00941","4193"
"2-Oxoglutaramate","C5H7NO4","C00940","4192"
"2-Aminoadenosine","C10H14N6O4","C00939","4191"
"Indole-3-acetate","C10H9NO2","C00954","4205"
"Estradiol-17beta","C18H24O2","C00951","4202"
"4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde","C9H11NO6","C04796","7358"
"alpha-Ionone","C13H20O","C12286","14430"
"2-Methylserine","C4H9NO3","C02115","5195"
"cis-1,2-Dihydrobenzene-1,2-diol","C6H8O2","C04091","6783"
"UDP-4-dehydro-6-deoxy-D-glucose","C15H22N2O16P2","C04089","6781"
"Pregna-4,9(11)-diene-3,20-dione","C21H28O2","C04084","6777"
"N6-(delta2-Isopentenyl)-adenine","C10H13N5","C04083","6776"
"N-Hydroxy-4-acetylaminobiphenyl","C14H13NO2","C04081","6775"
"N-((R)-Pantothenoyl)-L-cysteine","C12H22N2O6S","C04079","6773"
"Methylmethionine sulfonium salt","C6H14ClNO2S","C04078","6772"
"L-2-Aminoadipate 6-semialdehyde","C6H11NO3","C04076","6771"
"(R,S)-3-Amino-2-methylpropanoate","C4H9NO2","C04095","6786"
"delta1-Piperideine-2-carboxylate","C6H9NO2","C04092","6784"
"Sulfometuron methyl","C15H16N4O5S","C10955","13138"
"Naproanilide","C19H17NO2","C10954","13137"
"Metalaxyl","C15H21NO4","C10947","13130"
"Metsulfuron methyl","C14H15N5O6S","C10946","13129"
"Nicosulfuron","C15H18N6O6S","C10949","13132"
"Metazachlor","C14H16ClN3O","C10948","13131"
"N-(Methylisothiazolin-5-ylidene)phenylacetamide","C20H16ClF3N2O2S","C10951","13134"
"Prosulfuron","C15H16F3N5O4S","C10950","13133"
"Metolachlor","C15H22ClNO2","C10953","13136"
"Rimsulfuron","C14H17N5O7S2","C10952","13135"
"Octylamine","C8H19N","C01740","4875"
"Palatinose","C12H22O11","C01742","4876"
"8-O-Methyltetrangulol","C20H14O4","C12398","582788"
"Lumichrome","C12H10N4O2","C01727","4864"
"Mannobiose","C12H22O11","C01728","4865"
"Medicarpin","C16H14O4","C01729","4866"
"Mesaconate","C5H6O4","C01732","4868"
"Methionine","C5H11NO2S","C01733","4869"
"Morphinone","C17H17NO3","C01735","4870"
"Nebularine","C10H12N4O4","C01736","4871"
"Neomycin B","C23H46N6O13","C01737","4872"
"6''-O-Malonyl-biochanin A-beta-D-glucoside","C25H26O13","C03593","6384"
"5-Methyl-2'-deoxycytidine","C10H15N3O4","C03592","6383"
"Inositol 1,2,3,4,5-pentakisphosphate","C6H17O21P5","C04579","7180"
"16-Methoxy-2,3-dihydro-3-hydroxytabersonine","C22H28N2O4","C04578","7179"
"2-Oxo-2,3-dihydrofuran-5-acetate","C6H6O4","C03586","6377"
"3-Chloro-cis,cis-muconate","C6H5ClO4","C03585","6376"
"3-(Uracil-1-yl)-L-alanine","C7H9N3O4","C03584","6375"
"3,4',5-Trihydroxystilbene","C14H12O3","C03582","6374"
"5-Chloro-3-methylcatechol","C7H7ClO2","C03591","6382"
"4-Hydroxyphenylglyoxylate","C8H6O4","C03590","6381"
"4-Hydroxy-2-oxopentanoate","C5H8O4","C03589","6380"
"4,5alpha-Dihydrocortisone","C21H30O5","C03588","6379"
"beta-Chamigrene","C15H24","C09637","11827"
"Aromatic amine","C6H7N","C02136","5215"
"S-Adenosyl-L-methionine","C15H22N6O5S","C00019","3321"
"Morusin","C25H24O6","C10106","12292"
"Nitroglycerin","C3H5N3O9","C07455","9658"
"N-Guanylhistamine","C6H12N5+","C07454","9657"
"Epinine","C9H13NO2","C07453","9656"
"Tizanidine","C9H8ClN5S","C07452","9655"
"Moxonidine","C9H12ClN5O","C07451","9654"
"Dexmedetomidine","C13H16N2","C07450","9653"
"Metiamide","C9H16N4S2","C07449","9652"
"Burimamide","C9H16N4S","C07448","9651"
"Acetylhydrazine","C2H6N2O","C07447","9650"
"Isonicotinic acid","C6H5NO2","C07446","9649"
"Asparagusate","C4H6O2S2","C01892","5005"
"4-Methyl-2,4-bis-(p-hydroxyphenyl)pent-1-ene","C18H20O2","C13625","586243"
"Bisphenol A","C15H16O2","C13624","586242"
"Monobromobisphenol A","C15H15BrO2","C13623","586241"
"Dibromobisphenol A","C15H14Br2O2","C13622","586240"
"Tribromobisphenol A","C15H13Br3O2","C13621","586239"
"Tetrabromobisphenol A","C15H12Br4O2","C13620","586238"
"Teicoplanin A3-1","C72H68Cl2N8O28","C13613","853975"
"Teicoplanin A2-5","C89H99Cl2N9O33","C13612","853974"
"Teicoplanin A2-4","C89H99Cl2N9O33","C13610","853972"
"Metipranolol hydrochloride","C17H28ClNO4","C13591","853953"
"7,4'-Dihydroxyflavan","C15H14O3","C09641","11831"
"Estramustine","C23H31Cl2NO3","C11228","13407"
"Ethionine","C6H13NO2S","C11227","13406"
"4-Methyl-L-glutamate","C6H11NO4","C06234","8476"
"L-Arabinose 1-phosphate","C5H11O8P","C06238","8479"
"Fe-enterobactin","C30H33FeN3O15","C06230","8473"
"Ectoine","C6H12N2O2","C06231","8474"
"Ferrichrome","C27H51FeN9O12","C06228","8471"
"Fe(III)dicitrate","C12H28FeO14","C06229","8472"
"Sedoheptulose 1-phosphate","C7H15O10P","C06222","8466"
"3,4-Dihydroxystyrene","C8H8O2","C06224","8467"
"Cellopentaose","C30H52O26","C06218","8464"
"Cellotriose","C18H32O16","C06219","8465"
"Pargyline","C11H13N","C07414","9618"
"Paramethasone","C22H29FO5","C07413","9617"
"Penbutolol","C18H29NO2","C07416","9620"
"Paroxetine","C19H20FNO3","C07415","9619"
"Pyridostigmine","C9H13N2O2+","C07410","9614"
"Pyrantel","C11H14N2S","C07409","9613"
"Pyrvinium","C26H28N3+","C07412","9616"
"Paramethadione","C7H11NO3","C07411","9615"
"Penicillamine","C5H11NO2S","C07418","9622"
"Penciclovir","C10H15N5O3","C07417","9621"
"Leucomycin A13","C41H69NO14","C14063","854301"
"Leucomycin A9","C37H61NO14","C14062","854300"
"Congo red","C32H22N6Na2O6S2","C14078","854315"
"Phthalocyanine","C32H18N8","C14077","854314"
"CBS 113A","C10H11ClN2OS","C14081","7846936"
"(-)-Catechin","C15H14O6","C14079","854316"
"cis-1,2-Dihydroxy-1,2-dihydro-8-methylnaphthalene","C11H12O2","C14083","854319"
"1-Methylnaphthalene","C11H10","C14082","854318"
"2-Hydroxy-8-methylchromene-2-carboxylate","C11H10O4","C14085","854321"
"1,2-Dihydroxy-8-methylnaphthalene","C11H10O2","C14084","854320"
"2-Dehydro-D-galactonate","C6H10O7","C03342","6185"
"Peonidin 3-O-glucoside","C22H23O11+","C12141","14288"
"Vetispiradiene","C15H24","C12142","14289"
"Unsaturated alcohol","C6H12O","C02893","5822"
"Anemone blue anthocyanin 4","C58H59O36+","C12133","14280"
"2'-Hydroxygenistein","C15H10O6","C12134","14281"
"2'-Hydroxybiochanin A","C16H12O6","C12135","14282"
"(-)-Epigallocatechin","C15H14O7","C12136","14283"
"Pelargonidin 3-O-glucoside","C21H21O10+","C12137","14284"
"Delphinidin 3-O-glucoside","C21H21O12+","C12138","14285"
"Petunidin 3-O-glucoside","C22H23O12+","C12139","14286"
"Malvidin 3-O-glucoside","C23H25O12+","C12140","14287"
"Thiamin acetic acid","C12H15N4O2S+","C02892","5821"
"CMP-N-acetylneuraminate","C20H31N4O16P","C00128","3428"
"Isopentenyl diphosphate","C5H12O7P2","C00129","3429"
"Ferrocytochrome c","C42H52FeN8O6S2","C00126","3426"
"Oxidized glutathione","C20H32N6O12S2","C00127","3427"
"Methanol","CH4O","C00132","3432"
"D-Alanine","C3H7NO2","C00133","3433"
"IMP","C10H13N4O8P","C00130","3430"
"dATP","C10H16N5O12P3","C00131","3431"
"Putrescine","C4H12N2","C00134","3434"
"L-Histidine","C6H9N3O2","C00135","3435"
"5-Oxoavermectin ''2b'' aglycone","C33H46O9","C11954","14115"
"Avermectin B2b aglycone","C33H48O9","C11955","14116"
"(+)-Isomenthone","C10H18O","C11952","14113"
"6,8a-Seco-6,8a-deoxy-5-oxoavermectin ''2b'' aglycone","C33H48O8","C11953","14114"
"3-Isopropylbut-3-enoic acid","C7H12O2","C11950","14111"
"(+)-cis-Isopulegone","C10H16O","C11951","14112"
"2,6-Dimethyl-5-methylene-3-oxo-heptanoyl-CoA","C31H50N7O18P3S","C11948","14109"
"3-Isopropylbut-3-enoyl-CoA","C28H46N7O17P3S","C11949","14110"
"cis-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA","C31H50N7O17P3S","C11946","14107"
"3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA","C31H52N7O18P3S","C11947","14108"
"Hydantoin","C3H4N2O2","C05146","7564"
"Toxyl angelate","C18H20O4","C08981","11173"
"Xylitol 5-phosphate","C5H13O8P","C02895","5824"
"(S)-N-[3-(3,4-Methylenedioxyphenyl)-2-(acetylthio)methyl-1-oxoprolyl]-(S)-alanine benzyl ester","C25H28N2O7S","C01316","4531"
"Hydrogen cyanide","CHN","C01326","4537"
"2,5-Diamino-6-hydroxy-4-(5'-phosphoribosylamino)-pyrimidine","C9H16N5O8P","C01304","4522"
"4-Deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine","C14H21NO11","C01310","4525"
"3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestan-26-al","C27H46O4","C01301","4519"
"1-(2-Carboxyphenylamino)-1'-deoxy-D-ribulose 5'-phosphate","C12H16NO9P","C01302","4520"
"(S)-N-[3-(3,4-Methylenedioxyphenyl)-2-(mercaptomethyl)-1-oxoprolyl]-(S)-alanine","C16H20N2O6S","C01314","4529"
"(S)-N-[3-(3,4-Methylenedioxyphenyl)-2-(acetylthio)methyl-1-oxoprolyl]glycine benzyl ester","C24H26N2O7S","C01315","4530"
"Prostaglandin I2","C20H32O5","C01312","4527"
"(S)-N-[3-(3,4-Methylenedioxyphenyl)-2-(mercaptomethyl)-1-oxoprolyl]glycine","C15H18N2O6S","C01313","4528"
"3-Aminoisobutanoate","C4H9NO2","C05145","7563"
"Dihydromyricetin","C15H12O8","C02906","5833"
"Clitidine 5'-phosphate","C11H15N2O9P","C08429","10624"
"Convicine","C10H15N3O8","C08430","10625"
"Progoitrin","C11H18NO10S2-","C08425","10620"
"Sinalbin","C14H18NO10S2-","C08426","10621"
"Sinigrin","C10H16NO9S2-","C08427","10622"
"(N-Sulfoindol-3-yl)methylglucosinolate","C16H18N2O12S3-2","C08428","10623"
"Glucoraphenin","C12H20NO10S3-","C08420","10616"
"4-Hydroxyglucobrassicin","C16H19N2O10S2-","C08422","10617"
"4-Methoxyglucobrassicin","C17H21N2O10S2-","C08423","10618"
"Neoglucobrassicin","C17H21N2O10S2-","C08424","10619"
"Dhurrin","C14H17NO7","C05143","7561"
"Estriol","C18H24O3","C05141","7560"
"3-methylthiopropanaldoxime","C5H11NOS","",""
"5-(5'-phospho-D-ribosyl-aminoformimino)-1-(5-phosphoribosyl)-imidazole-4-carboxamide","C15H25N5O15P2","","3079"
"3-thiazol-2'-yl-indole","C11H8N2S","","586933"
"indole carboxyl thiazole","C12H8N2O2S","",""
"indole-S-cysteine-adduct","C12H14N2O3S","",""
"4-diphosphocytidyl-2-C-methylerythritol","C14H25N3O14P2","","2503"
"4-diphosphocytidyl-2-C-methylerythritol 2-phosphate","C14H26N3O17P3","","2504"
"(R)-Hydroxyglutarate","C5H8O5","C02911","5835"
"2-Propenyl glucosinolate","C10H16KNO9S2","","215746"
"gamma-butyrobetaine-CoA","C28H50N8O17P3S","","2734"
"Acetylcholine","C7H16NO2+","C01996","5093"
"Acetone oxime","C3H7NO","C01995","5092"
"Allyl alcohol","C3H6O","C02001","5097"
"Acrylonitrile","C3H3N","C01998","5095"
"3-Ethylmalate","C6H10O5","C01989","5086"
"2-Nitrophenol","C6H5NO3","C01988","5085"
"5'-Oxoinosine","C10H10N4O5","C01993","5090"
"3-Oxalomalate","C6H6O8","C01990","5087"
"Aspulvinone E","C17H12O5","C02006","5102"
"Aristolochene","C15H24","C02004","5100"
"16alpha-Hydroxydehydroepiandrosterone","C19H28O3","C05139","7558"
"17alpha-Hydroxypregnenolone","C21H32O3","C05138","7557"
"Glaucolide B","C21H26O10","C09465","11656"
"Ipecoside","C27H35NO12","C09464","11655"
"Glaucolide A","C23H28O10","C09463","11654"
"(-)-alpha-Hydrastine","C21H21NO6","C09462","11653"
"Hernandezine","C39H44N2O7","C09461","11652"
"Heliamine","C11H15NO2","C09460","11651"
"Hasubanonine","C21H27NO5","C09459","11650"
"Gyrocarpine","C37H40N2O6","C09458","11649"
"Glaziovine","C18H19NO3","C09457","11648"
"Geigerin","C15H20O4","C09456","11647"
"Glitoxin","C13H14N2O4S2","C10595","12778"
"Halfordinol","C14H10N2O2","C10596","12779"
"Harringtonine","C28H37NO9","C10597","12780"
"Himbacine","C22H35NO2","C10598","12781"
"Homaline","C30H42N4O2","C10599","12782"
"Ibotenic acid","C5H6N2O4","C10600","12783"
"Isoficine","C20H19NO4","C10601","12784"
"Lilaline","C20H17NO7","C10602","12785"
"Lunarine","C25H31N3O4","C10603","12786"
"Lythramine","C29H37NO5","C10604","12787"
"3-Hydroxy-L-glutamate","C5H9NO5","C03066","5966"
"3-Guanidinopropanoate","C4H9N3O2","C03065","5965"
"3-Hydroxyhexobarbital","C12H16N2O4","C03068","5968"
"3-Hydroxybenzaldehyde","C7H6O2","C03067","5967"
"3-Oxo-5beta-cholanate","C24H38O3","C03070","5970"
"3-Methylcrotonyl-CoA","C26H42N7O17P3S","C03069","5969"
"3alpha-Hydroxysteroid","C19H32O","C03072","5972"
"(-)-Chimonanthine","C22H26N4","C09133","11325"
"Ceceline","C19H16N2O2","C09130","11322"
"Chanoclavine-I","C16H20N2O","C09131","11323"
"Marrubiin","C20H28O4","C09128","11320"
"Catharine","C46H54N4O10","C09129","11321"
"Genistein 7-O-beta-D-glucoside","C21H20O10","C09126","11318"
"Mancinellin","C36H52O8","C09127","11319"
"2-Ketoepimanool","C20H32O2","C09124","11316"
"Lathyrol","C20H30O4","C09125","11317"
"Rutacridone epoxide","C19H17NO4","C10739","12922"
"Skimmianine","C14H13NO4","C10740","12923"
"Swietenidin B","C11H11NO3","C10741","12924"
"Tryptanthrine","C15H8N2O2","C10742","12925"
"Ribalinium","C16H20NO4+","C10735","12918"
"Robustine","C12H9NO3","C10736","12919"
"Phrymarolin I","C24H24O11","C10737","12920"
"Rutacridone","C19H17NO3","C10738","12921"
"Vasicinol","C11H12N2O2","C10743","12926"
"Vasicinone","C11H10N2O2","C10744","12927"
"Dehydrodieugenol","C20H22O4","C10550","12733"
"Cubebin","C20H20O6","C10549","12732"
"Urethane","C3H7NO2","C01537","4698"
"4'-Demethyldeoxypodophyllotoxin","C21H20O7","C10552","12735"
"5'-Demethoxydeoxypodophyllotoxin","C21H20O6","C10551","12734"
"Austrobailignan 1","C21H18O7","C10546","12729"
"(-)-Arctigenin","C21H24O6","C10545","12728"
"Cleistanthin A","C28H28O11","C10548","12731"
"Burseran","C22H26O6","C10547","12730"
"1-Hydroxy-2-naphthaldehyde","C11H8O2","C11427","13599"
"cis-4-(1'-Hydroxynaphth-2'-yl)-2-oxobut-3-enoate","C14H10O4","C11426","13598"
"2-Hydroxy-2H-benzo[h]chromene-2-carboxylate","C14H10O4","C11425","13597"
"Phenanthracene","C14H10","C11422","13596"
"Phenanthrene-1,2-oxide","C14H10O","C11431","13603"
"9-Hydroxyphenanthrene","C14H10O","C11430","13602"
"Phenanthrene-9,10-oxide","C14H10O","C11429","13601"
"trans-9(S),10(S)-Dihydrodiolphenanthrene","C14H12O2","C11428","13600"
"1-Methoxyphenanthrene","C15H12O","C11433","13605"
"1-Phenanthrol","C14H10O","C11432","13604"
"Glutinosone","C14H20O2","C09673","11863"
"Ofloxacin","C18H20FN3O4","C07321","9529"
"Graphinone","C16H24O5","C09674","11864"
"Olanzapine","C17H20N4S","C07322","9530"
"Tiliacorine","C36H36N2O5","C09667","11857"
"Olsalazine","C14H10N2O6","C07323","9531"
"Kolanone","C33H42O4","C09948","12134"
"Ethylene oxide","C2H4O","C06548","8778"
"Ethylene","C2H4","C06547","8777"
"Omeprazole","C17H19N3O3S","C07324","9532"
"Deoxynupharidine","C15H23NO","C09945","12131"
"Rescinnamine","C35H42N2O9","C06540","8770"
"Reserpine","C33H40N2O9","C06539","8769"
"Ajmaline","C20H26N2O2","C06542","8772"
"Deserpidine","C32H38N2O8","C06541","8771"
"Veratridine","C36H51NO11","C06544","8774"
"Solanidine","C27H43NO","C06543","8773"
"Mescaline","C11H17NO3","C06546","8776"
"Conessine","C24H40N2","C06545","8775"
"S-[(E)-Prop-1-enyl]-L-cysteine S-oxide","C6H11NO3S","C08295","10493"
"Quisqualic acid","C5H7N3O5","C08296","10494"
"Clindamycin phosphate","C18H34ClN2O8PS","C11728","13893"
"L-Hypoglycin","C7H11NO2","C08287","10485"
"L-Indospicine","C7H15N3O2","C08288","10486"
"Isowillardiine","C7H9N3O4","C08289","10487"
"L-Lathyrine","C7H10N4O2","C08290","10488"
"3-Methylamino-L-alanine","C4H10N2O2","C08291","10489"
"alpha-(Methylenecyclopropyl)glycine","C6H9NO2","C08292","10490"
"Se-Methyl-L-selenocysteine","C4H9NO2Se","C08293","10491"
"O-Oxalylhomoserine","C6H9NO6","C08294","10492"
"Pepsinostreptin","C33H61N5O9","C11610","13775"
"Nigericin","C40H68O11","C11609","13774"
"Nafenopin glucuronide","C26H30O9","C11608","13773"
"Cinmethylin","C18H26O2","C10903","13086"
"NAc-FnorLRF-amide","C32H46N8O5","C11606","13771"
"NAc-DNP-Cys","C11H11N3O7S","C11605","13770"
"N-tert-Butyloxycarbonyl-deacetyl-leupeptin","C23H44N6O5","C11604","13769"
"Monochloro-monoglutathionyl melphalan","C23H34ClN5O8S","C11603","13768"
"Pristinamycin IA","C45H54N8O10","C11615","13780"
"Phenyl beta-D-glucopyranoside","C12H16O6","C11611","13776"
"N1-Acetylspermidine","C9H21N3O","C00612","3886"
"Phytol","C20H40O","C01389","4582"
"Maleic acid","C4H4O4","C01384","4579"
"2-Benzimidazolylguanidine","C8H9N5","C10898","13081"
"3-Dehydro-L-gulonate","C6H10O7","C00618","3892"
"Carbendazim","C9H9N3O2","C10897","13080"
"3-Oxo-delta4-steroid","C19H28O","C00619","3893"
"dTDP-beta-L-mycarose","C17H28N2O14P2","C06631","8857"
"D-Ribose 1-phosphate","C5H11O8P","C00620","3894"
"Tamoxifen","C26H29NO","C07108","9319"
"Ethylbenzene","C8H10","C07111","9322"
"1-Phenylethanol","C8H10O","C07112","9323"
"Acetophenone","C8H8O","C07113","9324"
"Benzoyl acetate","C9H8O3","C07114","9325"
"Mechlorethamine","C5H11Cl2N","C07115","9326"
"Meclizine","C25H27ClN2","C07116","9327"
"Meclofenamate","C14H11Cl2NO2","C07117","9328"
"Benzoyl acetyl-CoA","C30H42N7O18P3S","C07118","9329"
"Medroxyprogesterone","C22H32O3","C07119","9330"
"N-Acetyl-L-glutamate","C7H11NO5","C00624","3897"
"Cob(II)alamin","C62H89CoN13O14P+2","C00541","3822"
"Cystathionine","C7H14N2O4S","C00542","3823"
"Methysergide","C21H27N3O2","C07199","9408"
"Testosterone","C19H28O2","C00535","3817"
"Cinnamoyl-CoA","C30H42N7O17P3S","C00540","3821"
"Malonamoyl-CoA","C24H39N8O18P3S","C06625","8851"
"Steryl sulfate","C17H28O4S","C02195","5263"
"Pyruvate oxime","C3H5NO3","C02193","5262"
"Thromboxane A2","C20H32O5","C02198","5266"
"Xanthoxin","C15H22O3","C13453","586193"
"Xanthoxic acid","C15H22O4","C13454","586194"
"Loxiglumide","C21H30Cl2N2O5","C12510","582900"
"Ethylenediamine","C2H8N2","C12511","582901"
"Pirenoxine","C16H8N2O5","C12497","582887"
"Bromperidol","C21H23BrFNO2","C12498","582888"
"Maxacalcitol","C26H42O4","C12495","582885"
"Iocarmic acid","C24H20I6N4O8","C12496","582886"
"Nateglinide","C19H27NO3","C12508","582898"
"Adapalene","C28H28O3","C12509","582899"
"Esonarimod","C14H16O4S","C12499","582889"
"Tannic acid","C76H52O46","C13452","586192"
"Azukisaponin III","C42H66O15","C08930","11122"
"Barringtogenol C","C30H50O5","C08931","11123"
"5,6,7,8-Tetrahydro-2-naphthol","C10H12O","C14309","157593"
"Methoprene","C19H34O3","C14308","179739"
"Z-Tyr-Leu-NHOH","C21H29N3O3","C02203","5271"
"Dicofol","C14H9Cl5O","C14301","151405"
"Di-n-pentyl phthalate","C18H26O4","C14300","151716"
"Equilenin","C18H18O2","C14303","153889"
"Dinoseb","C10H12N2O5","C14302","149960"
"4-Hexyloxyphenol","C12H18O2","C14305","171685"
"Furamizole","C12H8N4O5","C14304","171024"
"11beta-Chloromethylestradiol","C19H25ClO2","C14307","209197"
"2-FURANACRYLAMIDE, 5-NITRO-","C7H6N2O4","C14306","156174"
"Betaine aldehyde","C5H12NO+","C00576","3855"
"3',5'-Cyclic AMP","C10H12N5O6P","C00575","3854"
"Mandelonitrile","C8H7NO","C00561","3841"
"Deoxyadenosine","C10H13N5O3","C00559","3839"
"Trimethylamine","C3H9N","C00565","3844"
"Phosphoramidon","C23H34N3O10P","C00563","3843"
"4-Aminobenzoate","C7H7NO2","C00568","3847"
"(3S)-Citryl-CoA","C27H42N7O22P3S","C00566","3845"
"Cyclohexylamine","C6H13N","C00571","3850"
"CDPethanolamine","C11H20N4O11P2","C00570","3849"
"Oxoamide","C10H12N2O2","","211919"
"4-Oxo-4-(3-pyridyl)-butanoic acid","C9H9NO3","","585028"
"17-Methyl-19-nortestosterone","C19H28O2","C14491","153863"
"Stenbolone","C20H30O2","C14490","3885500"
"17-Ethinyl testosterone","C21H28O2","C14487","153122"
"Norethindrone enanthate","C27H38O3","C14486","162582"
"19-Nor-P","C20H28O2","C14489","672745"
"21-Fluoroprogesterone","C21H29FO2","C14488","776955"
"17alpha-Methylestradiol","C19H26O2","C14483","208497"
"3beta-Hydroxypregn-5-ene","C21H34O","C14482","679765"
"17beta-Dihydroequilin","C18H22O2","C14485","162043"
"9-Fluoroprednisolone","C21H27FO5","C14484","152775"
"Gentiodelphin","C51H53O28+","C08641","10834"
"Delphinidin 3,3',5'-tri-O-glucoside","C33H41O22+","C08640","10833"
"Cyanin","C27H31O16+","C08639","10832"
"Tingenone","C28H36O3","C08638","10831"
"Taraxerol","C30H50O","C08637","10830"
"Taraxasterol","C30H50O","C08636","10829"
"Taccalonolide A","C36H46O14","C08635","10828"
"Sapelin A","C30H50O4","C08634","10827"
"Hirsutidin","C18H17O7+","C08643","10836"
"Heavenly blue anthocyanin","C79H91O45+","C08642","10835"
"Dihydroneopterin","C9H13N5O4","C04874","7426"
"1-Hexadecylthio-2-hexadecanoylamino-1,2-dideoxy-sn-glycero-3-phosphocholine","C39H82N2O6PS+","C04873","7425"
"(RS)-2-[4-(3-Chloro-5-(trifluoromethyl-2-pyridyloxy)phenoxy]-propionic acid","C15H11ClF3NO4","C04871","7423"
"Methyl(2E,6E)-(10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate","C17H28O3","C04867","7422"
"4-Deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine6-sulfate","C14H21NO14S","C04865","7420"
"4-Deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine4-sulfate","C14H21NO14S","C04864","7419"
"1-Hexadecylthio-1-deoxy-2-hexadecylphosphono-sn-glycero-3-phosphocholine","C39H84NO7P2S+","C04862","7417"
"1,3-alpha-D-Mannosyl-1,2-alpha-D-mannosyl-1,2-alpha-D-mannosyl-D-mannose","C24H42O21","C04861","7416"
"(S)-4,5-Dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylicacid","C11H8N2O3S2","C04860","7415"
"(20S,22S,25S)-22,25-Epoxyfurost-5-ene-3beta,26-diol3-O-beta-D-glucoside","C33H52O9","C04859","7414"
"p-Mercuribenzoate","C7H5HgO2","C00985","4232"
"alpha-D-Galactose","C6H12O6","C00984","4231"
"N-Acetylserotonin","C12H14N2O2","C00978","4227"
"L-Tryptophanamide","C11H13N3O","C00977","4226"
"Renilla luciferin","C26H21N3O3","C00982","4230"
"O-Acetyl-L-serine","C5H9NO4","C00979","4228"
"Dihydrokaempferol","C15H12O6","C00974","4223"
"4-Pyridoxolactone","C8H7NO3","C00971","4220"
"GDP-D-mannuronate","C16H23N5O17P2","C00976","4225"
"Dihydroxyfumarate","C4H4O6","C00975","4224"
"4-Imidazolone-5-acetate","C5H6N2O3","C05133","7553"
"(5-Hydroxyimidazole)-4-acetate","C5H6N2O3","C05134","7554"
"(1-Ribosylimidazole)-4-acetate","C10H14N2O6","C05131","7551"
"2-Hydroxy-3-[4-imidazolyl]-propanoate","C6H8N2O3","C05132","7552"
"Lutein 5,6-epoxide","C40H56O3","C08602","10795"
"Lycoxanthin","C40H56O","C08603","10796"
"Dimethyl citraconate","C7H10O4","C05126","7547"
"Elastin","C27H48N6O6","C00373","3663"
"N-Methylhistamine","C6H11N3","C05127","7548"
"Oleanoglycotoxin-A","C48H78O18","C08963","11155"
"Tos-Ph-CH2Cl","C14H13ClO2S","C01964","5065"
"5-Hydroxypentanoate","C5H10O3","C02804","5754"
"beta-Hederin","C41H66O11","C08955","11147"
"alpha-Hederin","C41H66O12","C08954","11146"
"Ilexolide A","C35H54O7","C08957","11149"
"Helianthoside A","C53H86O21","C08956","11148"
"Medicagenic acid 3-O-triglucoside","C48H76O21","C08959","11151"
"Silandrin","C25H22O9","C08600","10793"
"Notoginsenoside R1","C47H80O18","C08961","11153"
"Musennin","C51H82O21","C08960","11152"
"Mucronine A","C29H38N4O4","C10009","12195"
"Mucronine B","C28H36N4O4","C10010","12196"
"Acenaphthenequinone","C12H6O2","C02807","5757"
"Tangeretin","C20H20O7","C10190","12376"
"Thymonin","C18H16O8","C10191","12377"
"(L-Seryl)adenylate","C13H20N6O9P+","C05820","8115"
"Ceanothine B","C29H36N4O4","C10001","12187"
"4-Aminobutanoyl-CoA","C25H43N8O17P3S","C02801","5751"
"Frangulanine","C28H44N4O4","C10003","12189"
"Hymenocardine","C37H50N6O6","C10004","12190"
"Integerrenine","C31H42N4O4","C10005","12191"
"Enterochelin","C30H27N3O15","C05821","8116"
"Integerrine","C35H39N5O4","C10007","12193"
"Secologanate","C16H22O10","C01957","5058"
"(S)-Canadine","C20H21NO4","C03329","6176"
"N-(Aminomethyl)urea","C2H7N3O","C06383","8619"
"Fucoxanthin","C42H58O6","C08596","10789"
"dGDP","C10H15N5O10P2","C00361","3652"
"2-Octaprenyl-6-methoxy-1,4-benzoquinone","C47H70O3","C05813","8108"
"Pregnenolone","C21H32O2","C01953","5056"
"2-Octaprenyl-3-methyl-6-methoxy-1,4-benzoquinone","C48H72O3","C05814","8109"
"2-Octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinone","C48H72O4","C05815","8110"
"Aldicarb","C7H14N2O2S","C11015","13198"
"4-Fluoroaniline","C6H6FN","C11014","13197"
"3-Fluoroaniline","C6H6FN","C11013","13196"
"Pencycuron","C19H21ClN2O","C11012","13195"
"Metoxuron","C10H13ClN2O2","C11011","13194"
"2-Fluoroaniline","C6H6FN","C11010","13193"
"Chlorbromuron","C9H10BrClN2O2","C11009","13192"
"2,6-Dinitrotoluene","C7H6N2O4","C11008","13191"
"Linuron","C9H10Cl2N2O2","C11007","13190"
"2,4-Dinitrotoluene","C7H6N2O4","C11006","13189"
"(-)-Borneol","C10H18O","C01766","4899"
"(-)-Carvone","C10H14O","C01767","4900"
"Xanthosine","C10H12N4O6","C01762","4895"
"(+)-Borneol","C10H18O","C01765","4898"
"Vomifoliol","C13H20O3","C01760","4893"
"Vomilenine","C21H22N2O3","C01761","4894"
"Triacetate","C6H8O4","C01757","4890"
"Vistamycin","C17H34N4O10","C01759","4892"
"Thiocyanate","CHNS","C01755","4888"
"Thiopurine","C5H4N4S","C01756","4889"
"myo-Inositol 4-phosphate","C6H13O9P","C03546","6349"
"Undecaprenyl diphosphate","C55H92O7P2","C03543","6347"
"2-Hydroxycinnamate","C9H8O3","C03549","6352"
"trans-2,3-Epoxysuccinate","C4H4O5","C03548","6351"
"(R)-3-Hydroxybutanoyl-CoA","C25H42N7O18P3S","C03561","6354"
"(2-Aminoethyl)phosphonate","C2H8NO3P","C03557","6353"
"1-Pyrroline-2-carboxylate","C5H7NO2","C03564","6356"
"(S)-Pregn-4-en-3,20-dione","C21H30O2","C03562","6355"
"2'-Phosphoadenylylsulfate","C10H15N5O13P2S","C03568","6360"
"2'-Hydroxydihydrodaidzein","C15H12O5","C03567","6359"
"Kievitone","C20H20O6","C01590","4745"
"4a-Carboxy-5a-cholesta-8,24-dien-3b-ol","C28H44O3","","853838"
"1-Caffeoyl-4-deoxyquinic acid","C16H18O8","C10432","12617"
"Caffeic acid 3-glucoside","C15H18O9","C10431","12616"
"1'-Acetoxychavicol acetate","C13H14O4","C10426","12611"
"Hispaglabridin A","C25H28O4","C10425","12610"
"Hildecarpin","C17H14O7","C10424","12609"
"(-)-Glyceollin II","C20H18O5","C10422","12608"
"beta-Asarone","C12H16O3","C10430","12615"
"Apiole","C12H14O4","C10429","12614"
"Anethole","C10H12O","C10428","12613"
"1'-Acetoxyeugenol acetate","C14H16O5","C10427","12612"
"Pergolide","C19H26N2S","C07425","9629"
"Pentoxifylline","C13H18N4O3","C07424","9628"
"Phenacemide","C9H10N2O2","C07428","9632"
"Perphenazine","C21H26ClN3OS","C07427","9631"
"Pentazocine","C19H27NO","C07421","9625"
"Pentamidine","C19H24N4O2","C07420","9624"
"Pentobarbital sodium","C11H17N2NaO3","C07423","9627"
"Pentobarbital","C11H18N2O3","C07422","9626"
"Phenelzine","C8H12N2","C07430","9634"
"Phenazopyridine","C11H11N5","C07429","9633"
"Ceftibuten dihydrate","C15H18N4O8S2","C13654","853995"
"Ampicillin sodium","C16H18N3NaO4S","C13652","853993"
"Difenoxin hydrochloride with atropine sulfate","C62H79ClN4O13S","C13661","854002"
"Tetracycline hydrochloride","C22H25ClN2O8","C13655","853996"
"1-(4'-Hydroxyphenyl)ethanol","C8H10O2","C13638","586254"
"4-Ethylphenol","C8H10O","C13637","586253"
"Debrisoquin","C10H13N3","C13650","7846928"
"m-Chlorophenylbiguanide","C8H10ClN5","C13646","586256"
"Doxycycline hyclate","C46H58Cl2N4O18","C13663","854004"
"Argipressin","C46H65N15O12S2","C13662","854003"
"(R,S)-Norlaudanosoline","C16H17NO4","C06350","8586"
"(R)-Norlaudanosoline","C16H17NO4","C06351","8587"
"4-O-Methyl-myo-inositol","C7H14O6","C06352","8588"
"6-O-Methyl-myo-inositol","C7H14O6","C06353","8589"
"Cyclohexane","C6H12","C11249","13426"
"(R)-Norcoclaurine","C16H17NO3","C06347","8583"
"6alpha-Glucuronosylhyodeoxycholate","C30H47O10-","C11246","13424"
"Glucuronosyletoposide","C35H39O19-","C11245","13423"
"Cholesteryl palmitate","C43H76O2","C11251","13428"
"Demecolcine","C21H25NO5","C11250","13427"
"Benzophenone","C13H10O","C06354","8590"
"2,3',4,6-Tetrahydroxybenzophenone","C13H10O5","C06355","8591"
"4-Methylsalicylate","C8H8O3","C14103","854339"
"cis-1,2-Dihydroxy-1,2-dihydro-7-methylnaphthalene","C11H12O2","C14102","854338"
"2-Naphthoic acid","C11H8O2","C14101","854337"
"4-Formylsalicylic acid","C8H6O4","C14100","854336"
"2-Naphthaldehyde","C11H8O","C14099","854335"
"2-Methylnaphthalene","C11H10","C14098","854334"
"2-Hydroxyisophthalic acid","C8H6O5","C14097","854333"
"3-Formylsalicylic acid","C8H6O4","C14096","854332"
"Lonchocarpenin","C27H28O6","C10491","12674"
"1,2-Dihydroxy-7-hydroxymethylnaphthalene","C11H10O3","C14105","854341"
"cis-1,2-Dihydroxy-1,2-dihydro-7-hydroxymethylnaphthalene","C11H12O3","C14104","854340"
"4-Chlorocatechol","C6H5ClO2","C02375","5417"
"Rosmarinic acid","C18H16O8","C10489","12672"
"Dihydrozeatin","C10H15N5O","C02029","5123"
"5-Oxoavermectin ''2a'' aglycone","C34H48O9","C11970","14131"
"Avermectin B2a aglycone","C34H50O9","C11971","14132"
"Avermectin A2a aglycone","C35H52O9","C11972","14133"
"Avermectin B2a monosaccharide","C41H62O12","C11973","14134"
"Avermectin A1b monosaccharide","C41H60O11","C11966","14127"
"Avermectin B1b","C47H70O14","C11967","14128"
"Avermectin A1b","C48H72O14","C11968","14129"
"6,8a-Seco-6,8a-deoxy-5-oxoavermectin ''2a'' aglycone","C34H50O8","C11969","14130"
"Avermectin A2a monosaccharide","C42H64O12","C11974","14135"
"Avermectin B2a","C48H74O15","C11975","14136"
"Ornoprostil","C23H38O6","C13341","586085"
"Aluminum monostearate","C18H43AlO4","C13339","586083"
"Miproxifene phosphate","C29H36NO5P","C13325","586069"
"Mepranoprofen arbamel","C20H22N2O4","C13323","586067"
"Pranazepide","C26H19FN4O2","C13330","586074"
"Kad 1229","C38H48CaN2O6","C13326","586070"
"Carbazochrome","C10H12N4O3","C13336","586080"
"Pentetreotide","C63H87N13O19S2","C13331","586075"
"Lornoxicam","C13H10ClN3O4S2","C13338","586082"
"Pelubiprofen","C16H18O3","C13337","586081"
"3-Hydroxy-2-methylpyridine-5-carboxylate","C7H7NO3","C01270","4489"
"1D-myo-Inositol 1,3,4,5-tetrakisphosphate","C6H16O18P4","C01272","4491"
"2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate","C12H10O4","C01273","4492"
"5-Formyl-5,6,7,8-tetrahydromethanopterin","C31H45N6O17P","C01274","4493"
"(3E)-4-(2-Carboxyphenyl)-2-oxobut-3-enoate","C11H8O5","C01275","4494"
"2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate","C7H6O6","C01278","4497"
"4-Amino-5-hydroxymethyl-2-methylpyrimidine","C6H9N3O","C01279","4498"
"Dihydrostreptomycin 3'alpha,6-bisphosphate","C21H43N7O18P2","C01280","4499"
"1-Amino-1-deoxy-scyllo-inositol 4-phosphate","C6H14NO8P","C01283","4502"
"1D-myo-Inositol 1,3,4,5,6-pentakisphosphate","C6H17O21P5","C01284","4503"
"alpha-D-Glucose","C6H12O6","C00267","3565"
"3-Dehydrosphinganine","C18H37NO2","C02934","5855"
"Dehydrofalcarinone","C17H20O","C08445","10638"
"Dehydromatricaria ester","C11H8O2","C08446","10639"
"Ustiloxin","C28H43N5O12S","C08442","10636"
"Victorin C","C31H45Cl3N6O13","C08443","10637"
"Falcarindiol","C17H24O2","C08449","10642"
"Falcarinol","C17H24O","C08450","10643"
"Dehydrosafynol","C13H10O2","C08447","10640"
"Eutypine","C12H10O2","C08448","10641"
"Falcarinone","C17H22O","C08451","10644"
"Ichthyotherol","C12H14O2","C08452","10645"
"Phosphatidyl Ethanol","C37H69O8P","","7889648"
"1-18:2-2-trans-16:1-sn-glycerol-3-phosphate","C37H67O8P","",""
"Dioleoyl lecithin","C44H84NO8P","","682487"
"isopentenyl-adenosine diphosphate","C15H23N5O10P2","",""
"trans-zeatin riboside diphosphate","C15H23N5O11P2","",""
"isopentenyl adenosine","C15H21N5O4","","166919"
"1-18:1-2-16:0-sn-glycerol-3-phosphate","C37H71O8P","",""
"5-dehydroavenasterol","C29H46O","",""
"Dilinoleoyllecithin","C44H80NO8P","","738352"
"Deoxycytosine","C4H7N3","C02026","5120"
"Kansuinine B","C38H42O14","C09122","11314"
"Athamantin","C24H30O7","C09123","11315"
"Jatrophone","C20H24O3","C09120","11312"
"Jodrellin A","C22H30O6","C09121","11313"
"Isopimaric acid","C20H30O2","C09118","11310"
"Jatrophatrione","C20H26O3","C09119","11311"
"Archangelicin","C24H26O7","C09116","11308"
"Isodonal","C22H28O7","C09117","11309"
"Inumakilactone A glycoside","C24H30O13","C09114","11306"
"Isodomedin","C22H32O6","C09115","11307"
"Boschnialactone","C9H14O2","C09772","11960"
"Eupatolide","C15H20O3","C09440","11631"
"6-Methoxytaxifolin","C16H14O8","C09770","11958"
"Asperuloside","C18H22O11","C09769","11957"
"Eupatocunin","C22H28O7","C09437","11628"
"Eupaserrin","C22H28O7","C09436","11627"
"Eupatocunoxin","C22H28O8","C09439","11630"
"Fagaronine","C21H20NO4+","C09438","11629"
"Fulvoplumierin","C14H12O4","C09778","11966"
"Dolichodial","C10H14O2","C09777","11965"
"Gigantine","C13H19NO3","C09445","11636"
"Fumaricine","C21H23NO5","C09444","11635"
"Cichorine","C10H11NO3","C10581","12764"
"Codonocarpine","C26H31N3O5","C10582","12765"
"Cephalomannine","C45H53NO14","C10579","12762"
"Cephalotaxine","C18H21NO4","C10580","12763"
"2,4,5-Tribromo-1-(4-chlorobenzoyl)imidazole","C10H4Br3ClN2O","C11128","13310"
"Isatin","C8H5NO2","C11129","13311"
"Candicine","C11H18NO+","C10575","12758"
"Cannabisativine","C21H39N3O3","C10576","12759"
"Etiocholan-3alpha-ol-17-one 3-glucuronide","C25H38O8","C11136","13318"
"(+)-Atherospermoline","C36H38N2O6","C11141","13323"
"Crinasiadine","C14H9NO3","C10583","12766"
"Crinasiatine","C22H17NO4","C10584","12767"
"1,4-Diguanidinobutane","C6H16N6","C03047","5950"
"(S,S)-Butane-2,3-diol","C4H10O2","C03046","5949"
"Strigol","C19H22O6","C09190","11382"
"(R,R)-Butane-2,3-diol","C4H10O2","C03044","5947"
"(R)-6-Hydroxynicotine","C10H14N2O","C03043","5946"
"(R)-2-Hydroxystearate","C18H36O3","C03042","5945"
"(+)-trans-Piperitenol","C10H18O","C03039","5943"
"(+)-Bornane-2,5-dione","C10H14O2","C03037","5942"
"Synaptolepis factor K1","C36H54O8","C09192","11384"
"Gabunamine","C42H50N4O5","C09193","11385"
"16beta-Hydroxysteroid","C19H32O2","C03050","5953"
"13-Hydroxydocosanoic acid","C22H44O3","C03049","5952"
"Flavonol 3-O-D-xylosylglucoside","C26H30O15","C04068","6763"
"Flavonol 3-O-D-xylosylglycoside","C26H30O15","C04069","6764"
"Tetraphenylarsonium","C24H21As","C11316","13491"
"Gibberellin 2-O-beta-D-glucoside","C25H34O11","C04070","6765"
"Lemmatoxin","C48H78O18","C08958","11150"
"Australine","C8H15NO4","C10132","12318"
"D-myo-Inositol 1,3-bisphosphate","C6H14O12P2","C04062","6759"
"N-Acetylhexosamine","C8H15NO6","C02711","5674"
"D-myo-Inositol 3,4-bisphosphate","C6H14O12P2","C04063","6760"
"D-myo-Inositol 4,5-bisphosphate","C6H14O12P2","C04064","6761"
"Diethyl 2-methyl-3-oxosuccinate","C9H14O5","C04067","6762"
"C-Curarine","C40H44N4O+2","C09144","11336"
"Ophiobolin A","C25H36O4","C09145","11337"
"N-Acetylmethionine","C7H13NO3S","C02712","5675"
"Eburnamine","C19H24N2O","C09146","11338"
"5beta-Cholestan-3-one","C27H46O","C03091","5989"
"Oryzalexin A","C20H30O2","C09148","11340"
"3,5-Dichlorocatechol","C6H4Cl2O2","C02933","5854"
"Eburnamonine","C19H22N2O","C09149","11341"
"Benzyl isothiocyanate","C8H7NS","C03098","5996"
"Aryl beta-D-glucoside","C12H16O6","C03097","5995"
"(1R,2R,4S)-Iso-dihydrocarveol","C10H18O","C11411","13585"
"(1R,2S,4S)- Neoiso-dihydrocarveol","C10H18O","C11410","13584"
"(3S,6R)-6-Isopropenyl-3-methyl-2-oxo-oxepanone","C10H16O2","C11403","13577"
"(4R,7R)-4-Isopropenyl-7-methyl-2-oxo-oxepanone","C10H16O2","C11402","13576"
"(3R)-3-Isopropenyl-6-oxoheptanoate","C10H15O3-","C11405","13579"
"(3R)-6-Hydroxy-3-isopropenyl-heptanoate","C10H17O3-","C11404","13578"
"(3R)-3-Isopropenyl-6-oxoheptanoyl-CoA","C31H50N7O18P3S","C11407","13581"
"(5R)-6-Hydroxy-5-isopropenyl-2-methylhexanoate","C10H17O3-","C11406","13580"
"(+)-trans-Carveol","C10H16O","C11409","13583"
"(4S,6S)-cis-Carveol","C10H16O","C11408","13582"
"cis-4-Carboxymethylenebut-2-en-4-olide","C6H4O4","C04431","7062"
"(E)-3,7-Dimethylocta-1,6-diene-3,8-diol","C10H18O2","C04433","7064"
"Zidovudine","C10H13N5O4","C07210","9419"
"D-Fructofuranose 1,2':2,3'-dianhydride","C12H20O10","C04420","7052"
"N-Succinyl-LL-2,6-diaminoheptanedioate","C11H18N2O7","C04421","7053"
"Nicotinamide hypoxanthine dinucleotide","C21H27N6O15P2+","C04423","7055"
"S-(2-Methylpropanoyl)-dihydrolipoamide","C12H23NO2S2","C04424","7056"
"S-Adenosyl-4-methylthio-2-oxobutanoate","C15H20N5O6S+","C04425","7057"
"UDP-N-acetyl-D-galactosamine 4-sulfate","C17H27N3O20P2S","C04426","7058"
"UDP-N-acetyl-beta-D-mannosaminouronate","C17H25N3O18P2","C04427","7059"
"alpha-D-Galactosyl-N-acetyllactosamine","C20H35NO16","C04428","7060"
"19-Hydroxytetrangulol","C19H12O5","C12399","582789"
"UK-47265","C13H12Cl2N6O","C11701","13866"
"5-Hydroxymethyl-4-methyluracil","C6H8N2O3","","152143"
"Tienilic acid","C13H8Cl2O4S","C11702","13867"
"Atorvastatin","C33H35FN2O5","C06834","9052"
"Atenolol","C14H22N2O3","C06833","9051"
"L-Isoprenaline","C11H17NO3","C11703","13868"
"Tetracycline","C22H24N2O8","C06570","8799"
"7a-Hydroxy-o-carbamoyl-deacetylcephalosporin C","C15H20N4O9S","C06569","8798"
"Amoxicillin-potassium clavulanate combination","C24H27KN4O10S","C06828","9046"
"Camoensine","C14H18N2O","C10758","12941"
"Baptifoline","C15H20N2O2","C10755","12938"
"Cadiamine","C15H26N2O3","C10756","12939"
"Genistein","C15H10O5","C06563","8792"
"Cinegalline","C23H30N2O6","C10762","12945"
"Anacardic acid","C22H36O3","C10759","12942"
"Amrinone","C10H9N3O","C06829","9047"
"Tramadol","C16H25NO2","C07153","9362"
"Tranylcypromine","C9H11N","C07155","9364"
"Medermycin","C16H12O6","C12437","582827"
"2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetate","C10H14O3","C07159","9368"
"2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetyl-CoA","C31H48N7O18P3S","C07160","9369"
"Methadone","C21H27NO","C07163","9372"
"Methamphetamine","C10H15N","C07164","9373"
"Triclofos","C2H4Cl3O4P","C07165","9374"
"Trientine","C6H18N4","C07166","9375"
"Trifluoperazine","C21H24F3N3S","C07168","9377"
"3alpha,12alpha-Dihydroxy-5beta-chol-6-enoate","C24H38O4","C11637","13802"
"7-Deoxyloganate","C16H24O9","C11636","13801"
"9-Riburonosylhypoxanthine","C10H10N4O5","C11631","13796"
"15,16-Dihydrobiliverdin","C33H36N4O6","C11630","13795"
"16-Epivellosimine","C19H20N2O","C11633","13798"
"Polyneuridine aldehyde","C21H22N2O3","C11632","13797"
"Desflurane","C3H2F6O","C07519","9722"
"Chlorimuron ethyl","C15H15ClN4O6S","C10943","13126"
"5-Androstene-3b,16a,17a-triol","C19H30O3","",""
"Isogentisin","C14H10O5","C10070","12256"
"Arabinonic acid","C5H10O6","","3733815"
"Isoathyriol","C14H10O6","C10069","12255"
"Dehydrosoyasaponin I","C48H76O18","C13837","854082"
"Lactobacillic acid","C19H36O2","C13838","854083"
"Dodecanamide","C12H25NO","C13831","854076"
"4Z,7Z,10Z-Octadecatrienenitrile","C18H29N","C13832","854077"
"7,10,13,16-Docosatetraenoylethanolamine","C24H41NO2","C13829","854074"
"BMS 204352","C16H10ClF4NO2","C13830","854075"
"NS 1608","C14H10ClF3N2O2","C13835","854080"
"N-Acetyl-D-mannosamine 6-phosphate","C8H16NO9P","C04257","6922"
"NS 1619","C15H8F6N2O2","C13833","854078"
"Tridecane","C13H28","C13834","854079"
"Etaconazole","C14H15Cl2N3O2","C11293","13468"
"N-Acetyl-leu-leu-leu-leu-tyr-amide","C35H58N6O7","C11295","13470"
"Nalpha,Nalpha-Dimethyl-L-histidine","C8H13N3O2","C04259","6924"
"2,4-Dinitrophenylhydrazine","C6H6N4O4","C11283","13460"
"Indolebutyric acid","C12H13NO2","C11284","13461"
"Tridemorph","C19H39NO","C11285","13462"
"16alpha,17beta-Estriol 3-(beta-D-glucuronide)","C24H32O9","C11288","13463"
"17beta-Estradiol 3-sulfate-17-(beta-D-glucuronide)","C24H31O11S-","C11289","13464"
"3-Chlorosalicylanilide","C13H10ClNO2","C11290","13465"
"Technetium Tc 99m sestamibi","C36H72N6O6Tc","C11291","13466"
"N-Acetylleucyl-leucyl-methioninal","C19H35N3O4S","C11292","13467"
"(9Z,12Z)-(8S)-Hydroxyoctadeca-9,12-dienoic acid","C18H32O3","C08318","10516"
"12-Hydroxydodecanoic acid","C12H24O3","C08317","10515"
"Tetracosanoic acid","C24H48O2","C08320","10518"
"(9Z,11E,13E)-4-Oxooctadeca-9,11,13-trienoic acid","C18H28O3","C08319","10517"
"Cetraxate","C17H23NO4","C01564","4722"
"Physcion 8-gentiobioside","C28H32O15","C10382","12568"
"Cyanamide","CH2N2","C01566","4723"
"Acalyphin","C14H20N2O9","C08324","10522"
"Metofluthrin","C18H20F4O3","C13487","853871"
"Clindamycin palmitate hydrochloride","C34H64Cl2N2O6S","C13489","853873"
"Phosphodimethylethanolamine","C4H12NO4P","C13482","586220"
"Estriol tripropionate","C27H36O6","C13485","853869"
"Luliconazole","C14H9Cl2N3S2","C13478","586216"
"Ximelagatran","C24H35N5O5","C13479","586217"
"Fentiazac","C17H12ClNO2S","C13473","586211"
"Gefitinib","C22H24ClFN4O3","C13475","586213"
"Lanatoside C","C49H76O20","C13470","586208"
"Tilmacoxib","C16H19FN2O3S","C13472","586210"
"Cortisone","C21H28O5","C00762","4024"
"Demissine","C50H83NO20","C10803","12986"
"3-Hydroxytetradecanedioic acid","C14H26O5","",""
"2-Hydroxymethylbenzoic acid","C8H8O3","C10804","12987"
"Bergaptol","C11H6O4","C00758","4020"
"2,2',3-Trihydroxybiphenyl","C12H10O3","C03569","6361"
"Berberine","C20H18NO4+","C00757","4019"
"4,4'-Methylenedianiline","C13H14N2","C14288","150657"
"4,4'-Methylenebis(2,6-di-tert-butylphenol)","C29H44O2","C14287","151518"
"Phenolphthalein","C20H14O4","C14286","149422"
"Flavanone","C15H12O2","C00766","4028"
"2,2'-Dihydroxybenzophenone","C13H10O3","C14284","212222"
"2,2'-Dihydroxy-4-methoxybenzophenone","C14H12O4","C14283","151723"
"2-Furylmercury chloride","C4H3ClHgO","C14282","164814"
"2-Deoxy-2,3-dehydro-N-acetylneuraminic acid","C11H17NO8","C04580","7181"
"Furfural diethyl acetal","C9H14O3","C14280","660464"
"Digitonin","C56H92O29","C00765","4027"
"Celapanine","C30H35NO10","C09937","12123"
"3',4',5,6-Tetrahydroxy-3,7-dimethoxyflavone","C17H14O8","C04581","7182"
"D-Sorbose","C6H12O6","C00764","4026"
"Diethyl (2S,3R)-2-methyl-3-hydroxysuccinate","C9H16O5","C04587","7187"
"D-Proline","C5H9NO2","C00763","4025"
"2-Iodophenol methyl ether","C7H7IO","C03575","6367"
"3-Hydroxydodecanoic acid","C12H24O3","","253558"
"2-Mercaptoethanesulfonate","C2H6O3S2","C03576","6368"
"3b,16a-Dihydroxyandrostenone sulfate","C19H28O6S","","746367"
"20-Hydroxy-leukotriene E4","C23H37NO6S","C03577","6369"
"2'-Deoxysepiapterin","C9H11N5O2","",""
"Glucarate","C6H10O8","C00767","4029"
"2-Deoxy-D-ribose 5-phosphate","C5H11O7P","C00673","3942"
"2-Deoxy-D-ribose 1-phosphate","C5H11O7P","C00672","3941"
"(S)-3-Methyl-2-oxopentanoic acid","C6H10O3","C00671","3940"
"sn-glycero-3-Phosphocholine","C8H21NO6P+","C00670","3939"
"gamma-L-Glutamyl-L-cysteine","C8H14N2O5S","C00669","3938"
"alpha-D-Glucose 6-phosphate","C6H13O9P","C00668","3937"
"LL-2,6-Diaminoheptanedioate","C7H14N2O4","C00666","3935"
"D-Fructose 2,6-bisphosphate","C6H14O12P2","C00665","3934"
"5-Formiminotetrahydrofolate","C20H24N8O6","C00664","3933"
"beta-D-Glucose 1-phosphate","C6H13O9P","C00663","3932"
"(Ethoxycarbonyl)acetic acid","C5H8O4","","212794"
"Desmosine","C24H40N5O8","","168173"
"Furan 2,5-dicarboxylic acid","C6H4O5","","339746"
"Phosphoribosyl carboxyaminoimidazole","C9H14N3O9P","","2527"
"Dipalmitoylphosphatidylcholine","C40H80NO8P","","597050"
"4a-Hydroxymethyl-4b-methyl-5a-cholesta- 8,24-dien-3b-ol","C29H48O2","","853828"
"4-Hydroxy-4-(3-pyridyl)-butanoic acid","C9H11NO3","","585029"
"4'-Phospho-N-pantothenoylcysteine","C12H23N2O9PS","","2035"
"Hydrobupropion","C13H20ClNO","","585032"
"trans-1,4-bis(2-Chlorobenzaminomethyl) cyclohexane dihydrochloride","C22H30Cl4N2","","152919"
"3,5-Diiodothyronine","C15H13I2NO4","","700393"
"Deuteroporphyrin IX","C30H30N4O4","","210091"
"2,2'-Iminodipropanoate","C6H11NO4","C03210","6085"
"Capsanthin","C40H56O3","C08584","10777"
"beta-Carotene 5,6-epoxide","C40H56O","C08587","10780"
"N-Acetyl-D-glucosaminyl-N-acetylmuramoyl-L-Ala-D-glutamyl-6-carboxy-L-lysyl-D-alanine","C37H61N7O21","C04904","7454"
"Luteolin7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide]-4'-O-beta-D-glucuronide","C33H34O24","C04900","7450"
"1-(4-Hydroxy-2-methylpyrimid-5-ylmethyl)-3-(beta-hydroxyethyl)-2-methylpyridinium bromide","C14H18BrN3O2-2","C04908","7458"
"1-(4-Amino-2-methylpyrimid-5-ylmethyl)-3-(beta-hydroxyethyl)-2-methylpyridinium bromide","C14H19BrN4O-2","C04905","7455"
"2-Amino-4-hydroxy-6-(erythro-1,2,3-trihydroxypropyl)dihydropteridinetriphosphate","C9H16N5O13P3","C04895","7446"
"UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-N6-(L-alanyl)-L-lysyl-D-alanyl-D-alanine","C43H70N10O27P2","C04894","7445"
"(6S)-6-beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adeninedinucleotide 2'-phosphate","C21H33N7O18P3+","C04899","7449"
"5-(5-Phospho-D-ribosylaminoformimino)-1-(5-phosphoribosyl)-imidazole-4-carboxamide","C15H25N5O15P2","C04896","7447"
"11-Deoxycorticosterone","C21H30O3","C03205","6081"
"2,3,2'3'-Tetrakis(3-hydroxytetradecanoyl)-D-glucosaminyl-1,6-beta-D-glucosamine 1,4'-bisphosphate","C68H130N2O23P2","C04919","7466"
"N-(5'-Phospho-D-1'-ribulosylformimino)-5-amino-1-(5''-phospho-D-ribosyl)-4-imidazolecarboxamide","C15H25N5O15P2","C04916","7464"
"12-Dehydrotetracycline","C22H22N2O8","C03206","6082"
"Reduced riboflavin","C17H22N4O6","C01007","4252"
"O-Phospho-L-serine","C3H8NO6P","C01005","4251"
"N-Methylnicotinate","C7H7NO2","C01004","4250"
"Hexose 1-phosphate","C6H13O9P","C01002","4248"
"(3S)-Citramalyl-CoA","C26H42N7O20P3S","C01011","4256"
"Urea-1-carboxylate","C2H4N2O3","C01010","4255"
"UDP-2-deoxyglucose","C15H24N2O16P2","C01009","4254"
"Trimethylsulfonium","C3H9S+","C01008","4253"
"3-Hydroxypropanoate","C3H6O3","C01013","4258"
"(R)-Pantolactone","C6H10O3","C01012","4257"
"Parapyruvate","C6H8O6","C06033","8305"
"4-Hydroxy-4-methylglutamate","C6H11NO5","C06034","8306"
"(2S)-Flavanone","C15H12O2","C02099","5182"
"(S)-Mevalonate","C6H12O4","C02104","5186"
"(S)-Reticuline","C19H23NO4","C02105","5187"
"(S)-Scoulerine","C19H21NO4","C02106","5188"
"alpha-Elemolic acid","C30H48O3","C08623","10816"
"1,2-Campholide","C10H16O2","C02108","5190"
"5-Methylcytosine","C5H7N3O","C02376","5418"
"6-Aminohexanoate","C6H13NO2","C02378","5420"
"4-Methylpentanal","C6H12O","C02373","5415"
"Soyasapogenol B","C30H50O3","C08980","11172"
"4-Fluorobenzoate","C7H5FO2","C02371","5413"
"Senegin II","C70H104O32","C08978","11170"
"Saponoside D","C87H138O49","C08977","11169"
"Saikosaponin BK1","C48H78O17","C08976","11168"
"3-Fluorobenzoate","C7H5FO2","C02364","5409"
"Sainfuran","C16H14O5","C08974","11166"
"Glycoprotein phospho-D-mannose","C34H58N5O26P","C04010","6719"
"Flavanone 7-O-beta-D-glucoside","C21H22O8","C04007","6717"
"1D-myo-Inositol 3-phosphate","C6H13O9P","C04006","6716"
"alpha-Cedrene","C15H24","C09630","11820"
"N2-(D-1-Carboxyethyl)-L-lysine","C9H18N2O4","C04020","6726"
"N-Acetyl-9-O-acetylneuraminate","C13H21NO10","C04017","6723"
"N-Acetyl-7-O-acetylneuraminate","C13H21NO10","C04016","6722"
"N-Acetyl-4-O-acetylneuraminate","C13H21NO10","C04015","6721"
"alpha-Chamigrene","C15H24","C09635","11825"
"Tecomine","C11H17NO","C09988","12174"
"Vitexin 2''-O-beta-D-glucoside","C27H30O15","C04024","6730"
"S,S-Dimethyl-beta-propiothetin","C5H10O2S","C04022","6728"
"Zinnolide","C15H18O5","C09983","12169"
"N-(p-Hydroxyphenethyl)actinidine","C18H22NO+","C09984","12170"
"Zearalenone","C18H22O5","C09981","12167"
"(3R)-3-Methyl-2-oxopentanoic acid","C6H10O3","C06008","8281"
"(R)-2,3-Dihydroxy-3-methylpentanoate","C6H12O4","C06007","8280"
"(S)-2-Aceto-2-hydroxybutanoate","C6H10O4","C06006","8279"
"Resmethrin","C22H26O3","C10991","13174"
"Flumiclorac pentyl","C21H23ClFNO5","C10990","13173"
"Flumipropyn","C18H15ClFNO3","C10993","13176"
"Tefluthrin","C17H14ClF7O2","C10992","13175"
"N-(3,5-Dichlorophenyl)succinimide","C10H7Cl2NO2","C10987","13170"
"Procymidone","C13H11Cl2NO2","C10986","13169"
"Fluvalinate","C26H22ClF3N2O3","C10989","13172"
"Fenvalerate","C25H22ClNO3","C10988","13171"
"Amitraz","C19H23N3","C10995","13178"
"Amdro","C25H24F6N4","C10994","13177"
"Chlordecone","C10Cl10O","C01792","4919"
"Choloyl-CoA","C45H74N7O20P3S","C01794","4921"
"Columbamine","C20H20NO4+","C01795","4922"
"D-Erythrose","C4H8O4","C01796","4923"
"Benzamidine","C7H8N2","C01784","4914"
"Benzenediol","C6H6O2","C01785","4915"
"CDPabequose","C15H25N3O14P2","C01788","4916"
"Campesterol","C28H48O","C01789","4917"
"D-Norvaline","C5H11NO2","C01799","4925"
"Deoxyribose","C5H10O4","C01801","4927"
"2-Pyrone-4,6-dicarboxylate","C7H4O6","C03671","6447"
"2-Carboxy-cis,cis-muconate","C7H6O6","C03666","6444"
"2-Amino-2-methylpropanoate","C4H9NO2","C03665","6443"
"2,4-Dichlorophenoxyacetate","C8H6Cl2O3","C03664","6442"
"2',4'-Dihydroxyacetophenone","C8H8O3","C03663","6441"
"2'-Hydroxypseudobaptigenin","C15H10O7","C03662","6440"
"1F-beta-D-Fructosylsucrose","C18H32O16","C03661","6439"
"3-O-Methyl-myo-inositol","C7H14O6","C03660","6438"
"3-(ADP)-2-phosphoglycerate","C13H20N5O16P3","C03673","6449"
"3-(4-Hydroxyphenyl)lactate","C9H10O4","C03672","6448"
"Rhamnetin","C16H12O7","C10176","12362"
"Aminoacetaldehyde","C2H5NO","C06735","8957"
"(E)-11-Tetradecenoyl-CoA","C35H60N7O17P3S","C06736","8958"
"1,2-Dihydroxy-6-methylcyclohexa-3,5-dienecarboxylate","C8H10O4","C06731","8953"
"alpha,beta-Didehydrotryptophan","C11H10N2O2","C06732","8954"
"8'-apo-beta-Carotenol","C30H42O","C06733","8955"
"14'-apo-beta-Carotenal","C22H30O","C06734","8956"
"cis-1,2-Dihydro-3-ethylcatechol","C8H12O2","C06727","8949"
"3-Ethylcatechol","C8H10O2","C06728","8950"
"cis-1,2-Dihydroxy-4-methylcyclohexa-3,5-diene-1-carboxylate","C8H10O4","C06729","8951"
"4-Methylcatechol","C7H8O2","C06730","8952"
"Formyl-CoA","C22H36N7O17P3S","C00798","4056"
"Rifampicin","C43H58N4O12","C06688","8913"
"3-Oxopimeloyl-CoA","C28H44N7O20P3S","C06715","8939"
"11-Dehydrocorticosterone","C21H28O4","C05490","7849"
"21-Deoxycortisol","C21H30O4","C05497","7850"
"11beta-Hydroxyprogesterone","C21H30O3","C05498","7851"
"17alpha,20alpha-Dihydroxycholesterol","C27H46O3","C05499","7852"
"21-Hydroxypregnenolone","C21H32O3","C05485","7845"
"17alpha,21-Dihydroxypregnenolone","C21H32O4","C05487","7846"
"11-Deoxycortisol","C21H30O4","C05488","7847"
"11beta,17alpha,21-Trihydroxypregnenolone","C21H32O5","C05489","7848"
"20alpha-Hydroxycholesterol","C27H46O2","C05500","7853"
"20alpha,22beta-Dihydroxycholesterol","C27H46O3","C05501","7854"
"3-Indoleacetaldoxime","C10H10N2O","C02937","5856"
"9-(5-Phospho-1-ribofuranosyl)-6-mercaptopurine","C10H13N4O7PS","C04646","7235"
"6-(D-Glucose-1-phospho)-D-mannosylglycoprotein","C40H68N5O31P","C04645","7234"
"2,3-Bis-O-(geranylgeranyl)glycerol 1-phosphate","C43H73O6P","C04638","7227"
"1,6-Dihydroxycyclohexa-2,4-diene-1-carboxylate","C7H8O4","C04634","7223"
"2-(Formamido)-N1-(5'-phosphoribosyl)acetamidine","C8H16N3O8P","C04640","7229"
"2,4-Dioxotetrahydropyrimidine D-ribonucleotide","C9H15N2O9P","C04639","7228"
"2-Hydroxy-5-carboxymethylmuconate semialdehyde","C8H8O6","C04642","7231"
"2-(alpha-D-Galactosyl)-sn-glycerol 3-phosphate","C9H19O11P","C04641","7230"
"3alpha,7alpha-Dihydroxy-5beta-cholestanoyl-CoA","C48H80N7O19P3S","C04644","7233"
"3alpha,12alpha-Dihydroxy-7-oxo-5beta-cholanate","C24H38O5","C04643","7232"
"Uroporphyrinogen I","C40H44N4O16","C05766","8061"
"Uroporphyrin I","C40H38N4O16","C05767","8062"
"3-Aminobenzenesulfonate","C6H7NO3S","C06334","8570"
"4-Aminobenzenesulfonate","C6H7NO3S","C06335","8571"
"gamma-Glutamyl-beta-cyanoalanine","C9H13N3O5","C05711","8018"
"alpha-Aminopropiononitrile","C3H6N2","C05714","8021"
"gamma-Amino-gamma-cyanobutanoate","C5H8N2O2","C05715","8022"
"Chelirubine","C21H16NO5+","C06327","8563"
"D-Pyrrolidone-5-carboxylate","C5H7NO3","C05722","8027"
"Glutathionylspermidine","C17H34N6O5S","C05730","8032"
"Quinoline-3,4-diol","C9H7NO2","C06330","8566"
"2-Methylquinoline-3,4-diol","C10H9NO2","C06331","8567"
"Emedastine","C17H26N4O","C07785","9987"
"Cetirizine","C21H25ClN2O3","C07778","9980"
"Buclizine","C28H33ClN2","C07777","9979"
"Azatadine","C20H22N2","C07774","9976"
"Ambenonium","C28H42Cl2N4O2+2","C07773","9975"
"Tazobactam","C10H12N4O5S","C07771","9973"
"Sulbactam","C8H11NO5S","C07770","9972"
"Azelastine","C22H24ClN3O","C07768","9970"
"Trichlormethiazide","C8H8Cl3N3O4S2","C07767","9969"
"Polythiazide","C11H13ClF3N3O4S3","C07766","9968"
"Cassinine","C44H51NO17","C09934","12120"
"Coniferin","C16H22O8","C00761","4023"
"Cephalexin","C16H17N3O4S","C06895","9112"
"Neomethymycin","C25H43NO7","C11995","14156"
"Ceftazidime","C22H22N6O7S2","C06889","9106"
"Cefprozil","C18H19N3O5S","C06888","9105"
"Cefoxitin","C16H17N3O7S2","C06887","9104"
"Cefotetan","C17H17N7O8S4","C06886","9103"
"2-Deoxy-5-keto-D-gluconic acid 6-phosphate","C6H11O9P","C06893","9110"
"2-Deoxy-5-keto-D-gluconic acid","C6H10O6","C06892","9109"
"D-2,3-Diketo 4-deoxy-epi-inositol","C6H8O5","C06891","9108"
"Ceftizoxime","C13H13N5O5S2","C06890","9107"
"Ro 61-8048","C17H15N3O6S2","C14126","7846940"
"UR-12947","C26H37N5O5S2","C14125","7846939"
"3-Hydroxybenzoate","C7H6O3","C00587","3866"
"Iomazenil","C15H14IN3O3","C14121","7846937"
"2-Naphthoyl-CoA","C32H42N7O17P3S","C14120","854356"
"BMS-268770","C23H30N4O4S2","C14123","7846938"
"R207910","C32H31BrN2O2","C14122","854357"
"Naphthyl-2-methylene-succinyl-CoA","C36H46N7O19P3S","C14117","854353"
"Naphthyl-2-methyl-succinyl-CoA","C36H48N7O19P3S","C14116","854352"
"Naphthyl-2-oxomethyl-succinyl-CoA","C36H46N7O20P3S","C14119","854355"
"Naphthyl-2-hydroxymethyl-succinyl CoA","C36H48N7O20P3S","C14118","854354"
"2-Hydroxybutane-1,2,4-tricarboxylate","C7H10O7","C01251","4471"
"4-(2-Aminophenyl)-2,4-dioxobutanoate","C10H9NO4","C01252","4472"
"7,8-Dihydro-7,8-dihydroxykynurenate","C10H9NO5","C01249","4469"
"N-Acetyl-L-glutamate 5-semialdehyde","C7H11NO4","C01250","4470"
"3,5-Diiodo-4-hydroxyphenylpyruvate","C9H6I2O4","C01244","4465"
"D-myo-Inositol 1,4,5-trisphosphate","C6H15O15P3","C01245","4466"
"N-Acetyl-beta-D-glucosaminylamine","C8H16N2O5","C01239","4460"
"1D-myo-Inositol 1,3,4-trisphosphate","C6H15O15P3","C01243","4464"
"N-(6-Aminohexanoyl)-6-aminohexanoate","C12H24N2O3","C01255","4475"
"1,2-Didehydropiperidine-2-carboxylate","C6H9NO2","C01258","4477"
"Choline phosphate","C5H14NO4P","C00588","3867"
"cis-3-hexenal","C6H10O","","165812"
"Kaempferol-3-glucoside-7-rhamnoside","C27H30O15","","7990711"
"POLYPRENYL-PPI","C9H18O7P2","","3089"
"indole-3-acetyl-leu","C16H20N2O3","","893374"
"4alpha-methylfecosterol","C29H48O","","770885"
"kaempferol-3-O-gentiobioside-7-O-rhamnoside","C33H40O20","",""
"L-CARNITINYL-COA","C28H50N8O18P3S","","2871"
"4-hydroxy-3-indolylmethyl-glucosinolate","C16H20N2O10S2","",""
"MK-8","C51H72O2","","3282"
"Kainic acid","C10H15NO4","C12819","583208"
"Crotamiton","C13H17NO","C12818","583207"
"Methenolone acetate","C22H32O3","C12812","583201"
"Allylestrenol","C21H32O","C12811","583200"
"Zopiclone","C17H17ClN6O3","C12808","583197"
"Vinpocetine","C22H26N2O2","C12807","583196"
"Isopropylantipyrine","C14H18N2O","C12817","583206"
"Proscillaridin","C30H42O8","C12816","583205"
"Bufogenin","C24H32O4","C12815","583204"
"Iodamide","C12H11I3N2O4","C12813","583202"
"Honokiol","C18H18O2","C10630","12813"
"Scandoside methyl ester","C17H24O11","C09798","11986"
"Plumieride","C21H26O12","C09797","11985"
"(+)-Neomatatabiol","C10H18O2","C09790","11978"
"Naringin","C27H32O14","C09789","11977"
"Nepetalactone trans-cis-form","C10H14O2","C09792","11980"
"Nepetalactone cis-trans-form","C10H14O2","C09791","11979"
"Oleuropein","C25H32O13","C09794","11982"
"Narirutin","C27H32O14","C09793","11981"
"Plumericin","C15H14O6","C09796","11984"
"Paederoside","C18H22O11S","C09795","11983"
"dADP","C10H15N5O9P2","C00206","3506"
"Acetone","C3H6O","C00207","3507"
"2,3-Dihydroxybenzoate","C7H6O4","C00196","3496"
"3-Phospho-D-glycerate","C3H7O7P","C00197","3497"
"D-Glucono-1,5-lactone","C6H10O6","C00198","3498"
"D-Ribulose 5-phosphate","C5H11O8P","C00199","3499"
"Phenazine methosulfate","C14H14N2O4S","C00200","3500"
"Isoflurophate","C6H14FO3P","C00202","3502"
"UDP-N-acetyl-D-galactosamine","C17H27N3O17P2","C00203","3503"
"2-Dehydro-3-deoxy-D-gluconate","C6H10O6","C00204","3504"
"Withaferin A","C28H38O6","C08841","11034"
"Withanolide D","C28H38O6","C08842","11035"
"Podolactone B","C19H22O9","C09172","11364"
"Podolide","C19H22O5","C09173","11365"
"Naphthalene-1,2-diol","C10H8O2","C03012","5919"
"N3'-Acetyltobramycin","C20H39N5O10","C03010","5917"
"N-Methylanthranilate","C8H9NO2","C03005","5914"
"N-Hydroxy-L-tyrosine","C9H11NO4","C03004","5913"
"Ponasterone A","C27H44O6","C08835","11028"
"Poriferasterol","C29H48O","C08836","11029"
"Eseramine","C16H22N4O3","C09170","11362"
"N-Acetylmuramoyl-Ala","C14H24N2O9","C02999","5908"
"N-Glucosylnicotinate","C12H16NO7+","C03003","5912"
"N-Caffeoylputrescine","C13H18N2O3","C03002","5911"
"3-Hydroxy-3-methylglutarate","C6H10O5","C03761","6518"
"4-(2-Aminoethyl)-1,2-benzenediol","C8H11NO2","C03758","6517"
"3,4-Dihydroxymandelonitrile","C8H7NO3","C03757","6516"
"3'-Deoxydihydrostreptomycin","C21H39N7O11","C03755","6514"
"Astrophylline","C19H26N2O","C10131","12317"
"Astrocasine","C20H26N2O","C10130","12316"
"Arecoline","C8H13NO2","C10129","12315"
"Arecaidine","C7H11NO2","C10128","12314"
"Anibine","C11H9NO3","C10127","12313"
"Anatabine","C10H12N2","C10126","12312"
"Ammodendrine","C12H20N2O","C10125","12311"
"Alexine","C8H15NO4","C10124","12310"
"Adenocarpine","C19H24N2O","C10123","12309"
"Quercetagetin","C15H10O8","C10122","12308"
"(+)-Comphene","C10H16","C06304","8540"
"2-Amino-2-deoxy-D-gluconate","C6H13NO6","C03752","6511"
"2,6-Dioxo-6-phenylhexanoate","C12H12O4","C03750","6510"
"Acetamide","C2H5NO","C06244","8483"
"N-Acetylneuraminate 9-phosphate","C11H20NO12P","C06241","8482"
"UDP-N-acetyl-D-mannosaminouronate","C17H25N3O18P2","C06240","8481"
"N,N-Dimethylaniline N-oxide","C8H11NO","C01183","4410"
"alpha-L-Arabinose 1-phosphate","C5H11O8P","C06239","8480"
"L-Arabinono-1,4-lactone","C5H8O5","C01114","4346"
"1-Deoxy-D-xylulose","C5H10O4","C06257","8496"
"4-Trimethylammoniobutanoate","C7H16NO2+","C01181","4408"
"2-Oxopentanoic acid","C5H8O3","C06255","8494"
"D-Ribulose 1,5-bisphosphate","C5H12O11P2","C01182","4409"
"Fargesone A","C21H24O6","C10563","12746"
"Lauroyl-KDO2-lipid IV(A)","C96H176N2O38P2","C06251","8490"
"Diphyllin","C21H16O7","C10559","12742"
"3-Hydroxy-2-methylpropanoate","C4H8O3","C01188","4414"
"(+)-Eudesmin","C22H26O6","C10561","12744"
"Eudesobovatol A","C33H44O4","C10562","12745"
"Deoxygomisin A","C23H28O6","C10555","12738"
"Deoxypodophyllotoxin","C22H22O7","C10556","12739"
"Dihydroanhydropodorhizol","C22H24O7","C10557","12740"
"5alpha-Cholest-7-en-3beta-ol","C27H46O","C01189","4415"
"(3S,5S)-3,5-Diaminohexanoate","C6H14N2O2","C01186","4412"
"(S)-(+)-alpha-Phellandrene","C10H16","C11391","13565"
"(+)-Menthone","C10H18O","C11390","13564"
"(+)-Linalool","C10H18O","C11389","13563"
"(-)-Linalool","C10H18O","C11388","13562"
"(1S,4R)-(-)-Fenchone","C10H16O","C11387","13561"
"3-Deoxy-D-manno-octulosonate","C8H14O8","C01187","4413"
"(S)-(-)-Citronellal","C10H18O","C11384","13558"
"(+)-(S)-Carvone","C10H14O","C11383","13557"
"(+)-3-Carene","C10H16","C11382","13556"
"Benzoyltropein","C15H19NO2","C11381","13555"
"P1,P4-Bis(5'-xanthosyl) tetraphosphate","C20H26N8O23P4","C04392","7032"
"Peptidoglycan(N-acetyl-D-glucosamine)","C34H60N8O18","C04394","7033"
"N2-(D-1,3-Dicarboxypropyl)-L-arginine","C11H20N4O6","C04389","7029"
"N6-Acetyl-LL-2,6-diaminoheptanedioate","C9H16N2O5","C04390","7030"
"Dihydrostreptomycin 3'alpha-phosphate","C21H42N7O15P","C04382","7023"
"Malonyl-flavonol 3-O-beta-D-glucoside","C24H24O14","C04385","7026"
"9,11alpha-Epoxypregn-4-ene-3,20-dione","C21H28O3","C04379","7020"
"Adenosine 5'-(gamma-thio)triphosphate","C10H16N5O12P3S","C04380","7021"
"5,10-Methylenetetrahydromethanopterin","C31H45N6O16P","C04377","7018"
"7-alpha-D-Ribosyladenine 5'-phosphate","C10H14N5O7P","C04378","7019"
"2-Hydroxy-6-oxo-6-(4'-chlorophenyl)-hexa-2,4-dienoate","C12H9ClO4","C06587","8815"
"2,3-Dihydroxy-4'-chlorobiphenyl","C12H9ClO2","C06586","8814"
"Acetazolamide","C4H6N4O3S2","C06805","9024"
"Acetaminophen","C8H9NO2","C06804","9023"
"Acetophenazine","C23H29N3O2S","C06807","9026"
"2-Hydroxy-3-carboxy-6-oxo-7-methylocta-2,4-dienoate","C10H12O6","C06581","8810"
"Acetylcysteine","C5H9NO3S","C06809","9028"
"4-Chlorobiphenyl","C12H9Cl","C06584","8812"
"Lincomycin","C18H34N2O6S","C06812","9031"
"Acyclovir","C8H11N5O3","C06810","9029"
"1,2,4-Trichlorobenzene","C6H3Cl3","C06594","8820"
"epsilon-Caprolactam","C6H11NO","C06593","8819"
"Methyltestosterone","C20H30O2","C07198","9407"
"Pseudoecgonyl-CoA","C30H49N8O18P3S","C12450","582840"
"Vidarabine","C10H15N5O5","C07195","9404"
"Methylphenidate","C14H19NO2","C07196","9405"
"Methotrimeprazine","C19H24N2OS","C07192","9401"
"Methyldopa anhydrous","C10H13NO4","C07194","9403"
"3-Dimethylallyl-4-hydroxymandelic acid","C13H16O4","C12457","582847"
"2-Hydroxyacetophenone","C8H8O2","C07189","9398"
"3-Dimethylallyl-4-hydroxybenzaldehyde","C12H14O2","C12459","582849"
"3-Dimethylallyl-4-hydroxybenzoate","C12H14O3","C12458","582848"
"Protorifamycin I","C35H45NO10","C12246","14391"
"Methyl5-(but-3-en-1-yl)amino-1,3,4-oxadiazole-2-carboxylate","C8H11N3O3","C12245","14390"
"Vinblastine","C46H58N4O9","C07201","9410"
"Metoprolol","C15H25NO3","C07202","9411"
"Violanthin","C27H30O14","C10196","12382"
"DuP 697","C17H12BrFO2S2","C11704","13869"
"Angelicin","C11H6O3","C09060","11252"
"Allogibberic acid","C18H20O3","C09061","11253"
"Antheridiogen-An","C20H24O6","C09062","11254"
"Asebotoxin II","C23H36O6","C09063","11255"
"Afrormosin","C17H14O5","C10199","12385"
"Nandrolone phenpropionate","C27H34O3","C08155","10355"
"Levuglandin D2","C20H32O5","C13808","854053"
"9,11,15-Trihydroxy-prosta-5,13-dien-1-oic acid","C20H34O5","C13809","854054"
"Clavulone I","C25H34O7","C13810","854055"
"Clavulone II","C25H34O7","C13812","854057"
"Clavulone III","C25H34O7","C13813","854058"
"Clavulone IV","C25H34O7","C13814","854059"
"Tetrapentylammonium","C20H44N+","C13815","854060"
"(9R,13R)-12-Oxo-phytodienoic acid","C18H28O3","C13816","854061"
"8-Br-cGMP","C10H11BrN5O7P","C13817","854062"
"F4-Neuroprostane (4-series)","C22H34O5","C13818","854063"
"n-Hexane","C6H14","C11271","13448"
"Fluorobenzene","C6H5F","C11272","13449"
"Biapenem","C15H18N4O4S","C11268","13445"
"Virginiamycin S1","C43H49N7O10","C11269","13446"
"8-Bromoadenosine","C10H12BrN5O4","C11266","13443"
"Benzbromarone","C17H12Br2O3","C11267","13444"
"7-Hydroxyflavone","C15H10O3","C11264","13441"
"8-Azaadenosine","C9H12N6O4","C11265","13442"
"5-Azacytidine","C8H12N4O5","C11262","13439"
"Retrorsine","C18H25NO6","C10364","12550"
"Tricin","C17H14O7","C10193","12379"
"Benzo[k]fluoranthene","C20H12","C14321","152349"
"Amoxicillin","C16H19N3O5S","C06827","9045"
"Tripamide","C16H20ClN3O3S","C13367","586111"
"Cilostazol","C20H27N5O2","C13368","586112"
"Rokitamycin","C42H69NO15","C13369","586113"
"Benzo[b]fluoranthene","C20H12","C14320","152344"
"Enprostil","C23H28O6","C13363","586107"
"Ethyl icosapentate","C22H34O2","C13364","586108"
"Iopromide","C18H24I3N3O8","C13365","586109"
"Rescimetol","C33H38N2O8","C13366","586110"
"Alacepril","C20H26N2O5S","C13372","586116"
"Docarpamine","C21H30N2O8S","C13375","586119"
"3-Carboxy-2-hydroxymuconate semialdehyde","C7H6O6","C04480","7100"
"2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate","C9H10O6","C04479","7099"
"Amoxapine","C17H16ClN3O","C06826","9044"
"2-(4-Hydroxybenzyl)isoindole-1,3-dione","C15H11NO3","C14264","6465879"
"N-Benzylphthalimide","C15H11NO2","C14263","217285"
"p-Chloroacetoacetanilide","C10H10ClNO2","C14266","150667"
"N-(p-Nitrobenzyl)phthalimide","C15H10N2O4","C14265","6854058"
"Diisobutyl adipate","C14H26O4","C14260","151978"
"Stanolone benzoate","C26H34O3","C14259","157297"
"p-Lactophenetide","C11H15NO3","C14262","675293"
"Trenbolone","C18H22O2","C14261","167801"
"(4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate","C6H8O6","C04471","7093"
"Fenpiclonil","C11H6Cl2N2","C14268","668539"
"2,6-Dihydroxyanthraquinone","C14H8O4","C14267","149767"
"(+/-)-2-(4'-Isobutylphenyl)propionitrile","C13H17N","C04469","7092"
"1,2-Dichlorobenzene","C6H4Cl2","C14328","150289"
"3-Deoxy-D-manno-octulosonate 8-phosphate","C8H15O11P","C04478","7098"
"1D-myo-Inositol 1,3,4,6-tetrakisphosphate","C6H16O18P4","C04477","7097"
"2-trans,6-trans-Farnesol","C15H26O","C01126","4357"
"Norethindrone acetate","C22H28O3","C08152","10352"
"D-Mannose 1-phosphate","C6H13O9P","C00636","3909"
"4-Hydroxybenzaldehyde","C7H6O2","C00633","3906"
"Prostaglandin F2alpha","C20H34O5","C00639","3912"
"Indole-3-acetaldehyde","C10H9NO","C00637","3910"
"2-Methylpropanoyl-CoA","C25H42N7O17P3S","C00630","3903"
"2-Dehydro-D-gluconate","C6H10O7","C00629","3902"
"Ecdysone","C27H44O6","C00477","3760"
"D-Lyxose","C5H10O5","C00476","3759"
"Sinapate","C11H12O5","C00482","3765"
"Pyrazole","C3H4N2","C00481","3764"
"5-Hydroxy-L-tryptophan","C11H12N2O3","C00643","3916"
"4-Hydroxyphenylacetate","C8H8O3","C00642","3915"
"Phospho-beta-D-glucoside","C6H13O9P","C01135","4366"
"N-Methacrylylglycine methyl ester","C7H11NO3","","173993"
"Stearoylcarnitine","C25H49NO4","",""
"Palmitoylcarnitine","C23H45NO4","","159294"
"N-Acetylgalactosamine 4,6-disulfate","C8H15NO12S2","","771226"
"N-Acetylgalactosamine 6-sulfate","C8H15NO9S","","770814"
"Monapterin","C9H11N5O4","",""
"Octenedioic acid","C8H12O4","",""
"N-n-Hexanoylglycine methyl ester","C9H17NO3","","7585459"
"N-a-Acetylcitrulline","C8H15N3O4","","854673"
"Pyridinoline","C18H28N4O8","","682549"
"Pelargonidin","C15H11O5+","C05904","8192"
"Cyanidin","C15H11O6+","C05905","8193"
"Pantetheine 4'-phosphate","C11H23N2O7PS","C01134","4365"
"Luteoforol","C15H14O6","C05907","8195"
"Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutaminyl-meso-2,6-diaminopimeloyl-(glycyl)5-D-alanyl-","C105H172N14O32P2","C05900","8188"
"3',4'-Anhydrovinblastine","C46H56N4O8","C11641","13806"
"3,3',4'5-Tetrahydroxystilbene","C14H12O4","C05901","8189"
"Dubinidine","C15H17NO4","C10662","12845"
"Kaempferol","C15H10O6","C05903","8191"
"Cycloartenol","C30H50O","C01902","5012"
"Norgestrel","C21H28O2","C08153","10353"
"Spectinomycin","C14H24N2O7","C02078","5164"
"Staurosporine","C28H26N4O3","C02079","5165"
"Sedoheptulose","C7H14O7","C02076","5162"
"Semicarbazide","CH5N3O","C02077","5163"
"Pseudouridine","C9H12N2O6","C02067","5155"
"Raucaffricine","C27H32N2O8","C02074","5160"
"Prostanoic acid","C20H38O2","C02064","5152"
"Pseudotropine","C8H15NO","C02066","5154"
"2,2-Dimethyl-8-prenylchromene 6-carboxylic acid","C17H20O3","C09003","11195"
"8-(3,3-Dimethylallyl)spatheliachromene","C20H22O4","C09002","11194"
"Stipitatonate","C9H4O6","C02080","5166"
"Streptonigrin","C25H22N4O8","C02081","5167"
"Debneyol","C15H26O2","C09653","11843"
"(+)-Tetrandrine","C38H42N2O6","C09654","11844"
"Cycloeudesmol","C15H26O","C09651","11841"
"Daucol","C15H26O2","C09652","11842"
"alpha-Curcumene","C15H22","C09649","11839"
"7,4'-Dihydroxy-8-methylflavan","C16H16O3","C09650","11840"
"Polygonolide","C12H12O4","C09963","12149"
"Purpurogallin","C11H8O5","C09964","12150"
"Sarothralin","C31H34O8","C09969","12155"
"Tephrowatsin A","C22H26O4","C09970","12156"
"Thalicarpine","C41H48N2O8","C09655","11845"
"Thalidasine","C39H44N2O7","C09656","11846"
"Columbianetin","C14H14O4","C09210","11401"
"Gelsemine","C20H22N2O2","C09207","11398"
"Haplophytine","C37H40N4O7","C09208","11399"
"Nitroethane","C2H5NO2","C01837","4956"
"Octadecanal","C18H36O","C01838","4957"
"Zoapatanol","C20H34O4","C09205","11396"
"L-Galactose","C6H12O6","C01825","4948"
"L-Norvaline","C5H11NO2","C01826","4949"
"Kanamycin A","C18H36N4O11","C01822","4946"
"Kanamycin C","C18H36N4O11","C01823","4947"
"Leu-Gly-Pro","C13H23N3O4","C01833","4952"
"Maltotriose","C18H32O16","C01835","4954"
"O-(4-Hydroxy-3,5-diidophenyl)-3,5-diiodo-L-tyrosine","C15H11I4NO4","C01829","4950"
"Lauroyl-CoA","C33H58N7O17P3S","C01832","4951"
"Hydroxyisopatchoulenone","C15H22O2","C09686","11876"
"2-Aminobutan-4-olide","C4H7NO2","C02926","5848"
"S-Acetyldihydrolipoamide","C10H19NO2S2","C01136","4367"
"1-Carbapen-2-em-3-carboxylic acid","C7H7NO3","C06669","8894"
"N-Benzoylanthranilate","C14H11NO3","C03141","6030"
"2,4-Dichlorobenzoate","C7H4Cl2O2","C06670","8895"
"5-Hydroxy-1,4-naphthoquinone","C10H6O3","C03840","6579"
"Bis(5'-adenosyl) pentaphosphate","C20H29N10O22P5","C04058","6757"
"9-cis,11-trans-Octadecadienoate","C18H32O2","C04056","6756"
"3-Hydroxy-2-methylpropanoyl-CoA","C25H42N7O18P3S","C04047","6748"
"3-(3,4-Dihydroxyphenyl)pyruvate","C9H8O5","C04045","6746"
"4-Hydroxyaminoquinoline N-oxide","C9H8N2O2","C04050","6751"
"4-Hydroxy-4-methyl-2-oxoadipate","C7H10O6","C04049","6750"
"5-Carboxy-2-oxohept-3-enedioate","C8H8O7","C04052","6753"
"5-Amino-4-imidazolecarboxyamide","C4H6N4O","C04051","6752"
"5-Hydroxybenzimidazolylcobamide","C59H86CoN13O15P-6","C04054","6755"
"5-Dehydro-4-deoxy-D-glucuronate","C6H8O6","C04053","6754"
"Vanillate","C8H8O4","C06672","8897"
"Sterol 3-beta-D-glucoside","C23H38O6","C03641","6423"
"Sphingosyl-phosphocholine","C23H50N2O5P+","C03640","6422"
"NG,NG-Dimethyl-L-arginine","C8H18N4O2","C03626","6410"
"N-Phosphohypotaurocyamine","C3H11N3O6PS+","C03624","6408"
"Phorbol 12,13-dibutanoate","C28H40O8","C03634","6417"
"Oleoylglycerone phosphate","C21H39O7P","C03630","6413"
"N-Acetoxy-4-aminobiphenyl","C14H13NO2","C03621","6405"
"Methyl beta-D-galactoside","C7H14O6","C03619","6403"
"N-Methyl-2-oxoglutaramate","C6H9NO4","C03623","6407"
"N-Hydroxy-4-aminobiphenyl","C12H11NO","C03622","6406"
"gamma-Glutamyl-Se-methylselenocysteine","C9H16N2O5Se","C05695","8002"
"3'-Phosphoadenylylselenate","C10H15N5O13P2Se","C05696","8003"
"Se-Adenosylselenomethionine","C15H24N6O5Se","C05691","7998"
"Se-Adenosylselenohomocysteine","C14H20N6O5Se","C05692","7999"
"Se-Methylselenocysteine","C4H9NO2Se","C05689","7996"
"Se-Methylselenomethionine","C6H14NO2Se+","C05690","7997"
"Adenylylselenate","C10H14N5O10PSe","C05686","7993"
"Selenocysteine","C3H7NO2Se","C05688","7995"
"Phosphonoacetate","C2H5O5P","C05682","7989"
"2-Aminoethylphosphocholate","C26H46NO7P","C05683","7990"
"15-Keto-prostaglandin F2alpha","C20H32O5","C05960","8244"
"Glycerol 1-phosphate","C3H9O6P","C00623","3896"
"Heliotridine","C8H13NO2","C10321","12507"
"Captopril","C9H15NO3S","C06867","9084"
"Capsaicin","C18H27NO3","C06866","9083"
"Carbenicillin","C17H18N2O6S","C06869","9086"
"Carbamazepine","C15H12N2O","C06868","9085"
"Carbinoxamine","C16H19ClN2O","C06871","9088"
"Chloroeremomycin","C73H88Cl2N10O26","C12014","14172"
"Carmustine","C5H9Cl2N3O2","C06873","9090"
"Carboprost","C21H36O5","C06872","9089"
"SM-17466","C20H21N4O5S2+","C12018","14175"
"Carteolol","C16H24N2O3","C06874","9091"
"Prenol","C5H10O","C01390","4583"
"Melezitose","C18H32O16","C08243","10442"
"sec-Butylbenzene","C10H14","C14142","7846954"
"4-sec-Butylphenol","C10H14O","C14139","7846953"
"2-sec-Butylphenol","C10H14O","C14138","7846952"
"6-Hydroxyflavone","C15H10O3","C14137","7846951"
"alpha-Zeacarotene","C40H58","C14146","7846958"
"(3S)-3-Hydroxyadipyl-CoA","C27H44N7O20P3S","C14145","7846957"
"5-Carboxy-2-pentenoyl-CoA","C27H42N7O19P3S","C14144","7846956"
"Adipyl-CoA","C27H44N7O19P3S","C14143","7846955"
"N-Cyclopropylammeline","C6H9N5O","C14148","7846960"
"Cyromazine","C6H10N6","C14147","7846959"
"Decenedioic acid","C10H18O4","",""
"Cholesteryl linolenate","C45H74O2","","391281"
"Erythro-3-hydroxy-2-methylbutyric acid","C5H10O3","",""
"Cholesteryl linoleate","C45H76O2","","81317"
"Coproporphyrin II","C36H38N4O8","","742545"
"Erythronic acid","C4H8O5","","3733816"
"Dipalmitoylphosphatidylserine","C38H74NO10P","","3882469"
"Etioporphyrin","C32H36N4","","718376"
"Ethylmalonic acid","C5H8O4","","303694"
"Diiodothyronine","C15H13I2NO4","","397276"
"Cefepime","C19H24N6O5S2","C08111","10311"
"Urapidil","C20H29N5O3","C12765","583154"
"Betamipron","C10H11NO3","C12763","583152"
"Tiaprofenic acid","C14H12O3S","C12757","583146"
"Metildigoxin","C42H66O14","C12756","583145"
"Mequitazine","C20H22N2S","C12755","583144"
"Azosemide","C12H11ClN6O2S2","C12754","583143"
"Clidanac","C16H19ClO2","C12762","583151"
"Oxendolone","C20H30O2","C12761","583150"
"Clotiazepam","C16H15ClN2OS","C12760","583149"
"Diflorasone diacetate","C26H32F2O7","C12759","583148"
"6-Aminopenicillanate","C8H12N2O3S","C02954","5872"
"7,8-Dihydrobiopterin","C9H13N5O3","C02953","5871"
"8-Oxodeoxycoformycin","C11H14N4O4","C02957","5874"
"7beta-Hydroxysteroid","C19H32O","C02956","5873"
"4-Hydroxybenzoyl-CoA","C28H40N7O18P3S","C02949","5868"
"4-Hydroxyhexan-3-one","C6H12O2","C02948","5867"
"5-Oxo-1,2-campholide","C10H14O3","C02952","5870"
"5-Hydroxyxanthotoxin","C12H8O5","C02951","5869"
"D-Allose 6-phosphate","C6H13O9P","C02962","5878"
"Cytosine arabinoside","C9H13N3O5","C02961","5877"
"2,5-Dichloro-4-oxohex-2-enedioate","C6H4Cl2O5","C12835","583224"
"2,5-Dichloro-carboxymethylenebut-2-en-4-olide","C6H2Cl2O4","C12834","583223"
"3-Chloro-cis-1,2-dihydroxycyclohexa-3,5-diene","C6H7ClO2","C12837","583226"
"2-Chloro-3-oxoadipate","C6H7ClO5","C12836","583225"
"Epirizole","C11H14N4O2","C12840","583229"
"trans-4-Carboxymethylenebut-2-en-4-olide","C6H4O4","C12838","583227"
"Pyricarbate","C11H15N3O4","C12842","583231"
"Actarit","C10H11NO3","C12841","583230"
"Bismuth subgallate","C7H11BiO6","C12844","583233"
"Ampiroxicam","C20H21N3O7S","C12843","583232"
"N(pai)-Methyl-L-histidine","C7H11N3O2","C01152","4381"
"Quercetin 3,3'-bissulfate","C15H10O13S2","C01155","4383"
"GDP-4-dehydro-6-deoxy-D-mannose","C16H23N5O15P2","C01222","4444"
"Methyl 2-diazoacetamidohexonate","C9H16N3O3+","C01223","4445"
"6-Phospho-2-dehydro-D-gluconate","C6H11O10P","C01218","4440"
"CDP-4-dehydro-6-deoxy-D-glucose","C15H23N3O15P2","C01219","4441"
"Streptomycin 6-phosphate","C21H40N7O15P","C01138","4369"
"(3S)-3,6-Diaminohexanoate","C6H14N2O2","C01142","4373"
"4-Trimethylammoniobutanal","C7H16NO+","C01149","4378"
"D-Ribose 1,5-bisphosphate","C5H12O11P2","C01151","4380"
"2-Hydroxy-3-oxopropanoate","C3H4O4","C01146","4376"
"5,6,7,8-Tetrahydromethanopterin","C30H45N6O16P","C01217","4439"
"L-Xylulose 5-phosphate","C5H11O8P","C03291","6148"
"L-threo-3-Phenylserine","C9H11NO3","C03290","6147"
"L-xylo-Hexulonolactone","C6H8O6","C03289","6146"
"L-Rhamnono-1,4-lactone","C6H10O5","C03288","6145"
"T-2 Toxin","C24H34O9","C09738","11926"
"Solavetivone","C15H22O","C09737","11925"
"Fisetinidol-4beta-ol","C15H14O6","C09736","11924"
"Nalpha-Methylhistidine","C7H11N3O2","C03298","6154"
"Farrerol","C17H16O5","C09734","11922"
"Sirenin","C15H24O2","C09733","11921"
"Eriocitrin","C27H32O15","C09732","11920"
"Epigallocatechin 3-gallate","C22H18O11","C09731","11919"
"beta-Sinensal","C15H22O","C09730","11918"
"N2-Succinyl-L-arginine","C10H18N4O5","C03296","6152"
"N-Adenylylanthranilate","C17H19N6O8P","C03293","6150"
"D-Xylulose 5-phosphate","C5H11O8P","C00231","3530"
"Succinate semialdehyde","C4H6O3","C00232","3531"
"Acetyl phosphate","C2H5O5P","C00227","3527"
"3,4-Dihydroxybenzoate","C7H6O4","C00230","3529"
"Adenylylsulfate","C10H14N5O10PS","C00224","3524"
"Methyl viologen","C12H14Cl2N2","C00225","3525"
"3-Oxopropanoate","C3H4O3","C00222","3522"
"4-Coumaroyl-CoA","C30H42N7O18P3S","C00223","3523"
"Methylene blue","C16H18ClN3S","C00220","3520"
"beta-D-Glucose","C6H12O6","C00221","3521"
"Diginatin","C41H64O15","C08861","11054"
"Digitalin","C36H56O14","C08862","11055"
"Cymarin","C30H44O9","C08859","11052"
"Decoside","C30H42O9","C08860","11053"
"Cerbertin","C32H44O11","C08857","11050"
"Convallatoxin","C29H42O10","C08858","11051"
"Calotropin","C29H40O9","C08855","11048"
"Thevetin B","C42H66O18","C08856","11049"
"Bryotoxin A","C32H42O12","C08853","11046"
"Calactin","C29H40O9","C08854","11047"
"Mivacurium","C58H80N2O14+2","C07550","9753"
"Doxacurium","C56H78N2O16+2","C07549","9752"
"Atracurium","C53H72N2O12+2","C07548","9751"
"Arnottin II","C20H14O7","C12258","14403"
"Succinylcholine","C14H30N2O4+2","C07546","9749"
"alpha-Ergocryptine","C32H41N5O5","C07545","9748"
"Ergotamine","C33H35N5O5","C07544","9747"
"Ergonovine","C19H23N3O2","C07543","9746"
"Calcitriol","C27H44O3","C01673","4817"
"3,4-Dihydroxypyridine","C5H5NO2","C02932","5853"
"Cadaverine","C5H14N2","C01672","4816"
"Luteolin 7-O-beta-D-glucoside","C21H20O11","C03951","6673"
"Toxicarol","C23H22O7","C10537","12720"
"Trifolirhizin","C22H22O10","C10538","12721"
"Endosulfan","C9H6Cl6O3S","C11090","13272"
"Texasin","C16H12O5","C10536","12719"
"Wedelolactone","C16H10O7","C10541","12724"
"Wighteone","C20H18O5","C10542","12725"
"(-)-Variabilin","C17H16O5","C10539","12722"
"Vestitol","C16H16O4","C10540","12723"
"Croconazole","C18H15ClN2O","C11096","13278"
"F5231","C12H14ClF2N5O3S","C11097","13279"
"Acanthoside D","C34H46O18","C10543","12726"
"1-Acetoxypinoresinol","C22H24O8","C10544","12727"
"(25S)-5beta-Spirostan-3beta-ol","C27H44O3","C03963","6684"
"CPT-11 carboxylate form","C33H39N4O7-","C11365","13539"
"Sulfobromophthalein","C20H10Br4O10S2","C11363","13538"
"Gsh-prostaglandin A1","C30H49N3O10S","C11367","13541"
"SN-38 carboxylate form","C22H21N2O6-","C11366","13540"
"(+)-Nornicotine","C9H12N2","C11360","13535"
"(-)-Hygrine","C8H15NO","C11359","13534"
"BQ 485","C35H44N6O5","C11362","13537"
"N-Acetylleukotriene E4","C25H39NO6S","C11361","13536"
"10beta-Hydroxy-6beta-isobutyrylfuranoeremophilane","C19H28O4","C09685","11875"
"Fluo-3","C36H30Cl2N2O13","C11369","13543"
"Grepafloxacin","C19H22FN3O3","C11368","13542"
"(3S)-3-Carboxy-3-hydroxypropanoyl-CoA","C25H40N7O20P3S","C04348","6997"
"(4S)-4,6-Dihydroxy-2,5-dioxohexanoate","C6H8O6","C04349","6998"
"(E)-4-Hydroxyphenylacetaldehyde-oxime","C8H9NO2","C04350","6999"
"(R)-2-Methylimino-1-phenylpropan-1-ol","C10H13NO","C04351","7000"
"N(alpha)-Benzyloxycarbonyl-L-leucine","C14H19NO4","C04335","6986"
"N-Glycolyl-D-mannosamine 6-phosphate","C8H16NO10P","C04336","6987"
"Ngamma-Nitro-L-arginine methyl ester","C7H15N5O4","C04337","6988"
"dTDP-4-amino-4,6-dideoxy-D-galactose","C16H27N3O14P2","C04346","6995"
"(R)-4'-Phosphopantothenoyl-L-cysteine","C12H23N2O9PS","C04352","7001"
"(Z)-4-Hydroxyphenylacetaldehyde-oxime","C8H9NO2","C04353","7002"
"Polyoxin B","C17H25N5O13","C06692","8917"
"dTDP-4-oxo-2,6-dideoxy-D-glucose","C16H24N2O14P2","C11922","14083"
"beta-D-Fructose 6-phosphate","C6H13O9P","C05345","7723"
"dTDP-D-olivose","C16H26N2O14P2","C11923","14084"
"Psicofuranin","C11H15N5O5","C05342","7720"
"dTDP-L-olivose","C16H26N2O14P2","C11920","14081"
"Haematoxylin","C16H14O6","C09931","12117"
"Pradimicin A","C40H44N2O18","C06784","9004"
"Pradimicin B","C35H36N2O14","C06783","9003"
"7-Hydroxylpradimicin A","C40H44N2O19","C06782","9002"
"7-Methoxypradimicinone II","C29H25NO12","C06781","9001"
"Pradimicinone II","C28H23NO12","C06780","9000"
"11-O-Demethyl-7-methoxypradimicinone II","C28H23NO12","C06779","8999"
"11-O-Demethylpradimicinone II","C27H21NO12","C06778","8998"
"Pradimicinone I","C28H23NO11","C06777","8997"
"Iproniazid","C9H13N3O","C11777","13941"
"beta-Alanyl-L-lysine","C9H19N3O3","C05341","7719"
"Pradimicin C","C39H42N2O18","C06786","9006"
"Dexylosylpradimicin C","C34H34N2O14","C06785","9005"
"Jadomycin B","C32H35NO9","C12395","582785"
"7alpha,12alpha-Dihydroxycholest-4-en-3-one","C27H44O3","C05457","7818"
"Prekinamycin","C18H10N2O4","C12393","582783"
"Stealthin C","C18H13NO4","C12392","582782"
"Kinobscurinone","C18H10O5","C12391","582781"
"ent-Copalyl diphosphate","C20H36O7P2","C06089","8355"
"Mithramycin","C52H76O24","C12389","582779"
"7alpha-Hydroxycholest-4-en-3-one","C27H44O2","C05455","7817"
"L-Cladinose","C8H16O4","C11917","14078"
"3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestane","C27H48O3","C05454","7816"
"Tetrangulol","C19H12O4","C12397","582787"
"Tetrangomycin","C19H14O5","C12396","582786"
"7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one","C27H46O3","C05453","7815"
"Chenodeoxyglycocholate","C26H43NO5","C05462","7822"
"Chenodeoxyglycocholoyl-CoA","C45H74N7O19P3S","C05461","7821"
"3-Phosphoglycerate","C3H7O7P","C00597","3874"
"Echinone","C19H20O6","C10338","12524"
"2-Hydroxy-2,4-pentadienoate","C5H6O3","C00596","3873"
"Jacobine","C18H25NO6","C10339","12525"
"Sulfoacetaldehyde","C2H4O4S","C00593","3872"
"Leucocyanidin","C15H14O7","C05906","8194"
"Quercetin 7-O-glucoside","C21H22O12","C03430","6257"
"L-Noradrenaline","C8H11NO3","C00547","3828"
"Quinacrine","C23H30ClN3O","C07339","9546"
"S-Inosyl-L-homocysteine","C14H19N5O6S","C03431","6258"
"1,10-Phenanthroline","C12H8N2","C00604","3879"
"(9Z,12Z)-(11S)-11-Hydroperoxyoctadeca-9,12-dienoic acid","C18H32O4","C07338","9545"
"Solanesyl pyrophosphate","C46H78O7P2","C03432","6259"
"(-)-Ureidoglycolate","C3H6N2O4","C00603","3878"
"Streptamine 4-phosphate","C6H15N2O7P","C03433","6260"
"Phenylacetaldehyde","C8H8O","C00601","3876"
"Tetrachlorohydroquinone","C6H2Cl4O2","C03434","6261"
"Benzoin","C14H12O2","C01408","4597"
"cis-4-Hydroxy-D-proline","C5H9NO3","C03440","6264"
"3-Bromo-2Z-heptenoic acid","C7H11BrO2","C13793","854038"
"Pitrazepin","C19H19N5","C13794","854039"
"(6R,7S)-6,7-Epoxyoctadecanoic acid","C18H34O3","C13791","854036"
"2-Methoxy-5Z-hexadecenoic acid","C17H32O3","C13792","854037"
"UCL 1608","C30H31N","C13788","854033"
"cis-4-Hydroxy-L-proline","C5H9NO3","C03441","6265"
"Cetiedil","C20H31NO2S","C13786","854031"
"17-Methyl-6Z-octadecenoic acid","C19H36O2","C13787","854032"
"dTDP-L-dihydrostreptose","C16H26N2O15P2","C03442","6266"
"2S-Amino-tridecanoic acid","C13H27NO2","C13795","854040"
"SR95531","C15H17N3O3","C13796","854041"
"Leu-leu-tyr","C21H33N3O5","C11331","13506"
"Leucyl-leucine","C12H24N2O3","C11332","13507"
"N-Acetyl-leucyl-leucine","C14H26N2O4","C11333","13508"
"N,N,N-Trimethylmethanaminium chloride","C4H12ClN","C11335","13510"
"2-Pyridyl hydroxymethane sulfonic acid","C6H7NO4S","C11327","13502"
"Leucyl-leucyl-norleucine","C18H35N3O4","C11328","13503"
"N-Acetyl-ala-ala-ala-methylester","C12H21N3O5","C11329","13504"
"N-Acetyl-leu-leu-tyr","C23H35N3O6","C11330","13505"
"Mersalyl acid","C13H18HgNO6","C11336","13511"
"Tetramisole hydrochloride","C11H13ClN2S","C11337","13512"
"Milrinone","C12H9N3O","C07224","9433"
"Minocycline","C23H27N3O7","C07225","9434"
"Zolpidem","C19H21N3O","C07219","9428"
"Mexiletine","C11H17NO","C07220","9429"
"Mezlin","C21H25N5O8S2","C07221","9430"
"Mibefradil","C29H38FN3O3","C07222","9431"
"2-Methylbenzaldehyde","C8H8O","C07214","9423"
"o-Toluate","C8H8O2","C07215","9424"
"3-Methylbenzyl alcohol","C8H10O","C07216","9425"
"Zolmitriptan","C16H21N3O2","C07218","9427"
"Colubrinoside","C50H78O19","C08937","11129"
"Hydrocortisone caproate","C27H40O6","C13422","586164"
"Israpafant","C28H29ClN4S","C13423","586165"
"(S,S)-Tartaric acid","C4H6O6","C02107","5189"
"Colubrin","C48H76O18","C08936","11128"
"Stearyl alcohol","C18H38O","C13401","586143"
"Sodium caffeine benzoate","C15H15N4NaO4","C13403","586145"
"Pratosartan","C25H26N6O","C13398","586140"
"Bufferin","C12H14AlMgNO11","C13400","586142"
"Sodium 3-ethyl-7-isopropyl-1-azulenesulfonate","C15H17NaO3S","C13414","586156"
"Cimicifugoside","C37H54O11","C08935","11127"
"Transfluthrin","C15H12Cl2F4O2","C13410","586152"
"Cromoglicate lisetil","C33H36N2O12","C13413","586155"
"Camellidin II","C53H84O24","C08934","11126"
"Dianoside A","C42H66O15","C08941","11133"
"Desglucomusennin","C45H72O16","C08940","11132"
"Cyclofoetoside B","C47H80O18","C08939","11131"
"Cyclamin","C58H94O27","C08938","11130"
"11-cis-Retinal","C20H28O","C02110","5192"
"2,3,4,5-Tetrahydropyridine-2-carboxylate","C6H9NO2","C00450","3738"
"N6-(L-1,3-Dicarboxypropyl)-L-lysine","C11H20N2O6","C00449","3737"
"5-Methyltetrahydrofolate","C20H25N7O6","C00440","3729"
"N-Formimino-L-glutamate","C6H10N2O4","C00439","3728"
"alpha-D-Ribose 1-phosphate","C5H11O8P","C00442","3731"
"L-Aspartate 4-semialdehyde","C4H7NO3","C00441","3730"
"alpha-D-Galactose 1-phosphate","C6H13O9P","C00446","3734"
"5,10-Methenyltetrahydrofolate","C20H22N7O6+","C00445","3733"
"trans,trans-Farnesyl diphosphate","C15H28O7P2","C00448","3736"
"Sedoheptulose 1,7-bisphosphate","C7H16O13P2","C00447","3735"
"(+/-)-3-Methyl-2-oxovaleric acid","C6H9NaO3","",""
"6-Chloropurine riboside","C10H11ClN4O4","","610567"
"3-dehydro-6-deoxoteasterone","C28H48O3","",""
"teasterone","C28H48O4","",""
"6-deoxoteasterone","C28H50O3","",""
"castasterone","C28H48O5","","709798"
"cathasterone","C28H48O3","",""
"6-oxocampestanol","C28H48O2","",""
"6-deoxocathasterone","C28H50O2","",""
"6alpha-hydroxycampestanol","C28H50O2","",""
"campestanol","C28H50O","","696073"
"dihydrozeatin-O-glucoside","C16H25N5O6","",""
"Solamargine","C45H73NO15","C10819","13002"
"Solanine","C45H73NO15","C10820","13003"
"Solanocapsine","C27H46N2O2","C10821","13004"
"Solasodine","C27H43NO2","C10822","13005"
"Protoveratrine A","C41H63NO14","C10815","12998"
"Protoveratrine B","C41H63NO15","C10816","12999"
"Protoverine","C27H43NO9","C10817","13000"
"Solacapine","C27H48N2O2","C10818","13001"
"(+)-Pimaric acid","C20H30O2","C09159","11351"
"Phenindione","C15H10O2","C07584","9786"
"16-a-Hydroxypregnenolone","C21H32O3","","3727447"
"3b-Allotetrahydrocortisol","C21H34O5","",""
"3b-Hydroxy-5-cholenoic acid","C24H38O3","","308203"
"1,1'-(1-Cyclobutene-1,2-diyl)bisbenzene","C16H14","","653884"
"21H,23H-Porphine-2,18-dipropanoic acid, 7,12-diethenyl-3,8,13,17-tetramethyl-, 18-methyl ester","C35H36N4O4","","744953"
"3,3-diethoxy-2-hydroxypropyl phosphate","C7H17O7P","","3795442"
"16b-Hydroxyestrone","C18H22O3","","691779"
"3a,7a,12b-Trihydroxy-5b-cholanoic acid","C24H40O5","",""
"3b,4b,7a,12a-Tetrahydroxy-5b-cholanoic acid","C24H40O6","",""
"3a,16b-Dihydroxyandrostenone","C19H28O3","",""
"Plastoquinol-1","C23H36O2","C02185","5256"
"Protoporphyrin","C34H34N4O4","C02191","5261"
"Phenol sulfate","C6H6O4S","C02180","5252"
"Phenoxyacetate","C8H8O3","C02181","5253"
"Phloroglucinol","C6H6O3","C02183","5254"
"Plastoquinal-9","C63H98O2","C02184","5255"
"Maleylpyruvate","C7H6O6","C02167","5242"
"Mefenamic acid","C15H15NO2","C02168","5243"
"Methylmalonate","C4H6O4","C02170","5245"
"N-Acetylisatin","C10H7NO3","C02172","5247"
"16-Oxosteroid","C19H30O2","C01986","5083"
"2-Aminophenol","C6H7NO","C01987","5084"
"Secologanin","C17H24O10","C01852","4969"
"Stipitatate","C8H6O5","C01853","4970"
"Streptamine","C6H14N2O4","C01854","4971"
"Taxiphyllin","C14H17NO7","C01855","4972"
"Thioacetate","C2H4OS","C01857","4974"
"Trichodiene","C15H24","C01860","4975"
"Xanthoaphin","C30H26O10","C01863","4977"
"Xanthotoxin","C12H8O4","C01864","4978"
"Zopolrestat","C19H12F3N3O3S","C01865","4979"
"(+)-Sabinone","C10H14O","C01868","4982"
"(Ac)2-L-Lys-D-Ala-D-Ala","C16H28N4O6","C03326","6174"
"(R)-2-(n-Propyl)-malate","C7H12O5","C03328","6175"
"Prolyl-2-naphthylamide","C15H16N2O","C03305","6160"
"Strictosidine aglycone","C21H24N2O4","C03309","6162"
"Thien-2-ylacetonitrile","C6H5NS","C03311","6164"
"Urate D-ribonucleotide","C10H13N4O10P","C03312","6165"
"Vitamin K hydroquinone","C31H48O2","C03313","6166"
"Xanthine-8-carboxylate","C6H4N4O4","C03314","6167"
"dTDP-6-deoxy-L-mannose","C16H26N2O15P2","C03319","6171"
"(6S)-Hydroxyhyoscyamine","C17H23NO4","C03325","6173"
"Fabianine","C14H21NO","C09949","12135"
"Lapachenole","C16H16O2","C09950","12136"
"Guaiazulene","C15H18","C09675","11865"
"Guaiol","C15H26O","C09676","11866"
"N-Glycolyl-D-mannosaminolactone","C8H13NO7","C03948","6671"
"Glycerol 1,2-cyclic phosphate","C3H7O5P","C03947","6670"
"Dendrobine","C16H25NO2","C09943","12129"
"Karwinskione","C32H32O7","C09944","12130"
"(2R,4S)-2,4-Diaminopentanoate","C5H12N2O2","C03943","6667"
"6beta-Hydroxyestradiol-17beta","C18H24O3","C03935","6661"
"5-Dehydro-2-deoxy-D-gluconate","C6H10O6","C03932","6659"
"3alpha-Hydroxyglycyrrhetinate","C30H46O4","C03930","6658"
"3-tert-Butyl-5-methylcatechol","C11H16O2","C03929","6657"
"3-Phosphoglycerol-glutathione","C13H24N3O11PS","C03928","6656"
"Vitamin D3","C27H44O","C05443","7805"
"3alpha,7alpha,26-Trihydroxy-5beta-cholestane","C27H48O3","C05444","7806"
"3alpha,7alpha-Dihydroxy-5beta-cholestan-26-al","C27H46O3","C05445","7807"
"3alpha,7alpha,12alpha,26-Tetrahydroxy-5beta-cholestane","C27H48O4","C05446","7808"
"3alpha,7alpha-Dihydroxy-5beta-cholest-24-enoyl-CoA","C48H78N7O19P3S","C05447","7809"
"3alpha,7alpha,24-Trihydroxy-5beta-cholestanoyl-CoA","C48H80N7O20P3S","C05448","7810"
"3alpha,7alpha-Dihydroxy-5beta-24-oxocholestanoyl-CoA","C48H78N7O20P3S","C05449","7811"
"3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestanoyl-CoA","C48H80N7O21P3S","C05450","7812"
"7alpha-Hydroxy-5beta-cholestan-3-one","C27H46O2","C05451","7813"
"3alpha,7alpha-Dihydroxy-5beta-cholestane","C27H48O2","C05452","7814"
"Benlate","C14H18N4O3","C10896","13079"
"Azafenidin","C15H13Cl2N3O2","C10895","13078"
"Methyl 5-hydroxy-2-benzimidazole carbamate","C9H9N3O3","C10902","13085"
"2-Aminobenzimidazole","C7H7N3","C10901","13084"
"Methyl oxalate","C4H6O4","C10900","13083"
"Allophanic acid, methyl ester","C3H6N2O3","C10899","13082"
"N-(Hydroxymethyl)urea","C2H6N2O2","C06384","8620"
"Dimethylenetriurea","C5H12N6O3","C06385","8621"
"N-(Carboxyaminomethyl)urea","C3H7N3O3","C06382","8618"
"3'-CMP","C9H14N3O8P","C05822","8117"
"D-Galactosamine 6-phosphate","C6H14NO8P","C06377","8613"
"Methylenediurea","C3H8N4O2","C06381","8617"
"beta-D-Gal-(1->4)-D-Glc","C12H22O11","C06373","8609"
"N-Acetyl-D-galactosamine 6-phosphate","C8H16NO9P","C06376","8612"
"3-Mercaptolactate","C3H5O3S-","C05823","8118"
"S-Sulfo-L-cysteine","C3H7NO5S2","C05824","8119"
"Trimethylenetetraurea","C7H16N8O4","C06386","8622"
"4-Chlorobenzoyl-CoA","C28H39ClN7O17P3S","C06387","8623"
"Aristolindiquinone","C12H10O4","C10300","12486"
"Europine","C16H27NO6","C10301","12487"
"Alkannin","C16H16O5","C10292","12478"
"Alkannin beta,beta-dimethylacrylate","C21H22O6","C10293","12479"
"Aloe-emodin","C15H10O5","C10294","12480"
"Alteichin","C20H14O6","C10295","12481"
"Altersolanol A","C16H16O8","C10296","12482"
"Anthragallol","C14H8O5","C10297","12483"
"Ardisianone","C24H38O5","C10298","12484"
"Echimidine","C20H31NO7","C10299","12485"
"Surfactin","C53H93N7O13","C12043","14198"
"Rifamycin","C37H47NO12","C12044","14199"
"Ansamitocin P3","C32H43ClN2O9","C12045","14200"
"Teicoplanin A2-2","C88H97Cl2N9O33","C12046","14201"
"Nanchangmycin","C47H78O14","C12047","14202"
"Griseorhodin A","C25H16O12","C12048","14203"
"Neocarzinostatin chromophore","C35H33NO12","C12049","14204"
"Everninomycin","C70H97Cl2NO38","C12050","14205"
"Micrococcin","C48H49N13O9S6","C12051","14206"
"Thiocillin","C49H51N13O8S6","C12052","14207"
"SC-58125","C17H12F4N2O2S","C11705","13870"
"Deferoxamine","C25H48N6O8","C06940","9155"
"Dantrolene","C14H10N4O5","C06939","9154"
"Danazol","C22H27NO2","C06938","9153"
"Dacarbazine","C6H10N6O","C06936","9152"
"Cyproheptadine","C21H21N","C06935","9151"
"Cyclopentolate","C17H25NO3","C06932","9149"
"Cyclobenzaprine","C20H21N","C06931","9148"
"Cyclizine","C18H22N2","C06930","9147"
"Demeclocycline hydrochloride","C21H22Cl2N2O8","C06942","9157"
"Delavirdine","C22H28N6O3S","C06941","9156"
"Hydroxyindole","C8H7NO","C02040","5131"
"L-Thyronine","C15H15NO4","","680124"
"Hematoporphyrin IX","C34H38N4O6","","309337"
"Isohyodeoxycholic acid","C24H40O4","",""
"Leucinic acid","C6H12O3","","669697"
"Cholesteryl palmitoleate","C43H74O2","","3883344"
"Cholestanol","C27H48O","","365071"
"Cholestane-3,7,12,25-tetrol","C27H48O4","","745214"
"Cysteineglutathione disulfide","C13H22N4O8S2","","3881679"
"Amlexanox","C16H14N2O4","C13298","586042"
"Dipalmitoylphosphatidic acid","C35H69O8P","","841039"
"Hydroxyacetic Porphyrin III","C39H38N4O15","",""
"Glycylglycine","C4H8N2O3","C02037","5129"
"Ropivacaine hydrochloride","C17H27ClN2O","C14004","854245"
"Erythromycin stearate","C55H103NO15","C13961","854203"
"Chloramphenicol sodium succinate","C15H15Cl2N2NaO8","C13962","854204"
"Tacrolimus hydrate","C44H71NO13","C13956","854198"
"Bufuralol","C16H23NO2","C13769","7846930"
"Carbenicillin sodium","C17H16N2Na2O6S","C13967","854208"
"Cefamandole sodium","C18H17N6NaO5S2","C13968","854209"
"2-Naphthylamine","C10H9N","C02227","5292"
"Mevastatin","C23H34O5","C13963","7846932"
"Diethyl phenyl phosphate","C10H15O4P","C11732","13897"
"SC-57666","C18H17FO2S","C11706","13871"
"Magnesium stearate","C36H70MgO4","C13966","154479"
"Tinidazole","C8H13N3O4S","C12872","583261"
"Lopinavir","C37H48N4O5","C12871","583260"
"Aluminum lactate","C9H21AlO9","C12870","583259"
"Propyl parahydroxybenzoate","C10H12O3","C12868","583257"
"p-Aminohippurate sodium","C9H9N2NaO3","C12867","583256"
"Butyl parahydroxybenzoate","C11H14O3","C12866","583255"
"Benzyl nicotinate","C13H11NO2","C12865","583254"
"Primaquine","C15H21N3O","C07627","9829"
"Oligomycin D","C44H72O11","C11314","13489"
"Tiopronin","C5H9NO3S","C12876","583265"
"Fosfluconazole","C13H13F2N6O4P","C12875","583264"
"D-Galactose 6-phosphate","C6H13O9P","C01113","4345"
"Nicotinate D-ribonucleotide","C11H14NO9P","C01185","4411"
"L-Galactono-1,4-lactone","C6H10O6","C01115","4347"
"O-Succinyl-L-homoserine","C8H13NO6","C01118","4349"
"Oxidized dithiothreitol","C4H8O2S2","C01119","4350"
"Sphinganine 1-phosphate","C18H40NO5P","C01120","4351"
"Streptidine 6-phosphate","C8H21N6O7P+2","C01121","4352"
"(-)-trans-Isopiperitenol","C10H16O","C01123","4354"
"18-Hydroxycorticosterone","C21H30O5","C01124","4355"
"Dihydro-4,4-dimethyl-2,3-Furandione","C6H8O3","C01125","4356"
"Palmitoylglycerone phosphate","C19H37O7P","C01192","4418"
"1-Phospho-alpha-D-glucuronate","C6H11O10P","C01195","4420"
"Voriconazole","C16H14F3N5O","C07622","9824"
"Borrerine","C16H20N2","C09054","11246"
"6-Acetylpicropolin","C24H28O9","C09055","11247"
"Ammoresinol","C24H30O4","C09056","11248"
"Acutilol A","C20H32O2","C09057","11249"
"Ajugarin I","C24H34O7","C09058","11250"
"Alectrol","C19H22O6","C09059","11251"
"Capillin","C12H8O","C08398","10594"
"Carlina oxide","C13H10O","C08399","10595"
"Anacyclin","C18H25NO","C08396","10592"
"5-(3-Buten-1-ynyl)-2,2'-bithienyl","C12H8S2","C08397","10593"
"Tritriacontane-16,18-dione","C33H64O2","C08394","10590"
"Aethusin","C13H14","C08395","10591"
"Triacontan-1-ol","C30H62O","C08392","10588"
"Tritriacontane","C33H68","C08393","10589"
"Propane-1-thiol","C3H8S","C08390","10586"
"Propane-2-thiol","C3H8S","C08391","10587"
"Chymostatin","C31H41N7O6","C11308","13483"
"omega-Carboxy-N-acetyl-LTE4","C25H37NO8S","C11629","13794"
"Afloqualone","C16H14FN3O","C13098","585162"
"Calcimycin","C29H37N3O6","C11309","13484"
"Acetylleucyl-leucyl-norleucinal","C20H37N3O4","C11306","13481"
"Glycyphyllin","C21H24O9","C09754","11942"
"Glepidotin B","C20H20O5","C09753","11941"
"Homoeriodictyol","C16H14O6","C09756","11944"
"Hesperidin","C28H34O15","C09755","11943"
"Zingiberene","C15H24","C09750","11938"
"alpha-Ylangene","C15H24","C09749","11937"
"Glabranin","C20H20O4","C09752","11940"
"Garbanzol","C15H12O5","C09751","11939"
"Oligomycin B","C45H72O12","C11312","13487"
"Isochamaejasmin","C30H22O10","C09758","11946"
"7-Hydroxyflavan","C15H14O2","C09757","11945"
"Oligomycin C","C45H74O10","C11313","13488"
"5,10-Methylenetetrahydrofolate","C20H23N7O6","C00143","3443"
"GMP","C10H14N5O8P","C00144","3444"
"Phenol","C6H6O","C00146","3446"
"Adenine","C5H5N5","C00147","3447"
"Butanoyl-CoA","C25H42N7O17P3S","C00136","3436"
"myo-Inositol","C6H12O6","C00137","3437"
"N-Acetyl-D-glucosamine","C8H15NO6","C00140","3440"
"3-Methyl-2-oxobutanoic acid","C5H8O3","C00141","3441"
"Oligomycin A","C45H74O11","C11311","13486"
"L-Proline","C5H9NO2","C00148","3448"
"(S)-Malate","C4H6O5","C00149","3449"
"Rhodexin A","C29H44O9","C08877","11070"
"Sarmentoloside","C29H44O11","C08878","11071"
"Scillaren A","C36H52O13","C08879","11072"
"Scilliroside","C32H44O12","C08880","11073"
"Lanceotoxin B","C32H44O11","C08873","11066"
"Lokundjoside","C29H44O10","C08874","11067"
"Musaroside","C30H44O10","C08875","11068"
"Neriifolin","C30H46O8","C08876","11069"
"k-Strophanthoside","C42H64O19","C08881","11074"
"Thevetin A","C42H64O19","C08882","11075"
"Hypaphorine","C14H18N2O2","C09213","11404"
"Ibogaine","C20H26N2O","C09214","11405"
"Pseudoconhydrine","C8H17NO","C10168","12354"
"D-Mannuronate","C6H10O7","C02024","5119"
"Ruspolinone","C14H19NO3","C10169","12355"
"Piplartine","C17H19NO5","C10166","12352"
"(+)-Prosopinine","C18H35NO3","C10167","12353"
"4-Carboxy-4'-sulfoazobenzene","C13H10N2O5S","C06673","8898"
"Picolinic acid","C6H5NO2","C10164","12350"
"Pinidine","C9H17N","C10165","12351"
"D-Erythrulose","C4H8O4","C02022","5117"
"Nigrifactin","C12H17N","C10162","12348"
"Nitramine","C10H19NO","C10163","12349"
"Zexbrevin B","C19H24O7","C09607","11798"
"2-Methylcrotanoyl-CoA","C26H42N7O17P3S","C03060","5960"
"Pilocereine","C45H65N3O6","C09609","11800"
"Phaeantharine","C39H40N2O6+2","C09608","11799"
"(+)-Pronuciferine","C19H21NO3","C09611","11802"
"Polycarpine","C21H23NO6","C09610","11801"
"Pukateine","C18H17NO3","C09613","11804"
"Psychotrine","C28H36N2O4","C09612","11803"
"Pycnamine","C37H40N2O6","C09615","11806"
"Butin","C15H12O5","C09614","11805"
"2-Hydroxyglutaryl-CoA","C26H42N7O20P3S","C03058","5958"
"Gibberellin A20","C19H24O5","C02035","5128"
"N3'-Acetylgentamicin","C19H36N4O11","C03009","5916"
"Bicalutamide","C18H14F4N2O4S","C08160","10360"
"2-Hydroxymethylserine","C4H9NO4","C03059","5959"
"Exemestane","C20H24O2","C08162","10362"
"2,6-Dihydroxypyridine","C5H5NO2","C03056","5956"
"Sibutramine","C17H26ClN","C07247","9456"
"2-Carboxybenzaldehyde","C8H6O3","C03057","5957"
"Methapyrilene","C14H19N3S","C11114","13296"
"5-Methyl-2-furaldehyde","C6H6O2","C11115","13297"
"Isoprothiolane sulfoxide","C12H18O5S2","C11112","13294"
"Nilutamide","C12H10F3N3O4","C08164","10364"
"Imidacloprid","C9H10ClN5O2","C11110","13292"
"Isoprothiolane","C12H18O4S2","C11111","13293"
"(-)-erythro-(2R,3R)-dihydroxybutylamide","C4H9NO3","C11108","13290"
"HBA","C4H9NO2","C11109","13291"
"Auraviketone","C21H16O8","C12417","582807"
"Calophyllolide","C26H24O5","C09158","11350"
"Gibberellin A19","C20H26O6","C02034","5127"
"Methylparabanic acid","C4H4N2O3","C11116","13298"
"5-N-Methyloxaluric acid","C4H6N2O4","C11117","13299"
"gamma-Aminooxaloacetate","C4H5NO4","C03443","6267"
"p-Chloromercuribenzoate","C7H5ClHgO2","C03444","6268"
"P1,P2-Bis(5'-adenosyl) triphosphate","C20H27N10O16P3","C04307","6965"
"Phosphoenol-4-deoxy-3-tetrulosonate","C4H7O7P","C04309","6967"
"Sodium thiosalicylate","C7H5NaO2S","C08171","10371"
"CDP-4-dehydro-3,6-dideoxy-D-glucose","C15H23N3O14P2","C04297","6956"
"D-myo-Inositol 1,2-cyclic phosphate","C6H11O8P","C04299","6958"
"5-(2-Hydroxyethyl)-4-methylthiazole","C6H9NOS","C04294","6954"
"Androst-5-ene-3beta,17beta-diol","C19H30O2","C04295","6955"
"N-(5-Phospho-D-ribosyl)anthranilate","C12H16NO9P","C04302","6961"
"N-Benzoyl-D-arginine-4-nitroanilide","C19H22N6O4","C04303","6962"
"Estradiol-17alpha 3-D-glucuronoside","C24H32O8","C04300","6959"
"N(alpha)-t-Butoxycarbonyl-L-leucine","C11H21NO4","C04301","6960"
"Urdamycin A","C43H56O17","C12413","582803"
"Levcromakalim","C16H18N2O3","C11697","13862"
"Gentamicin C2","C20H41N5O7","C02033","5126"
"Nelfinavir","C32H45N3O4S","C07257","9466"
"Anandamide","C22H37NO2","C11695","13860"
"Tetranactin","C44H72O12","C06764","8984"
"Nojirimycin","C6H13NO5","C06763","8983"
"2-Hydroxy-5-methyl-cis,cis-muconic semialdehyde","C7H8O4","C06760","8980"
"p-Tolualdehyde","C8H8O","C06758","8979"
"4-Hydroxy-2-oxohexanoic acid","C6H10O4","C06762","8982"
"(4E)-2-Oxohexenoic acid","C6H8O3","C06761","8981"
"Chloroacetic acid","C2H3ClO2","C06755","8976"
"Chloroacetaldehyde","C2H3ClO","C06754","8975"
"4-Methylbenzyl alcohol","C8H10O","C06757","8978"
"p-Xylene","C8H10","C06756","8977"
"Urdamycin F","C43H58O18","C12411","582801"
"Farnesoyl-CoA","C36H58N7O17P3S","C02030","5124"
"Urdamycinone F","C25H28O11","C12410","582800"
"Oxypertine","C23H29N3O2","C12619","583009"
"Quinupristin-dalfopristin","C87H117N13O19S2","C08034","10234"
"3-Methylbut-2-enal","C5H8O","C07330","9538"
"Methantheline","C21H26NO3+","C07849","10051"
"Oxyphencyclimine","C20H28N2O3","C07851","10053"
"Propiverine","C23H29NO3","C07852","10054"
"Mupirocin calcium hydrate","C52H90CaO20","C13972","854213"
"Methicillin sodium","C17H21N2NaO7S","C13973","854214"
"S9947","C29H27N3O3","C13771","854017"
"Clofilium","C21H37ClN+","C13772","854018"
"Tiapamil","C26H37NO8S2","C13765","854013"
"Emopamil","C23H30N2","C13766","854014"
"H37","C15H14O5","C13767","854015"
"12-Nitro-9Z,12Z-octadecadienoic acid","C18H31NO4","C13958","854200"
"CGP 28-392","C18H17F2NO5","C13761","586347"
"202-791","C17H18N4O5","C13762","586348"
"Devapamil","C26H36N2O3","C13763","854011"
"Gallopamil","C28H40N2O5","C13764","854012"
"Compound IV","C20H26N2O3","C06496","8727"
"Compound III(S)","C22H30N2O3","C06495","8726"
"Tridihexethyl iodide","C21H36INO","C07862","10064"
"WIN VI","C18H22N2O3","C06490","8721"
"Compound VII","C18H21ClN2O3","C06489","8720"
"XV638","C41H38N6O5S2","C06488","8719"
"(6R)-6-(L-erythro-1,2-Dihydroxypropyl)-7,8-dihydro-6H-pterin","C9H12N4O2","C06487","8718"
"Compound V(S)","C19H24N2O3","C06494","8725"
"WIN54954","C18H20Cl2N2O3","C06493","8724"
"Compound II(R/S)","C21H27ClN2O3","C06492","8723"
"Compound WIN VIII","C21H26Cl2N2O6","C06491","8722"
"Nalbuphine","C21H27NO4","C07251","9460"
"Naloxone","C19H21NO4","C07252","9461"
"Letrozole","C17H11N5","C08163","10363"
"Nafcillin","C21H22N2O5S","C07250","9459"
"Nedocromil","C19H17NO7","C07255","9464"
"Nefazodone","C25H32ClN5O2","C07256","9465"
"Naltrexone","C20H23NO4","C07253","9462"
"Nandrolone","C18H26O2","C07254","9463"
"UH-301","C16H24FNO","C11698","13863"
"Hydrocortisone cypionate","C29H42O6","C08176","10376"
"Nogalonic acid methyl ester","C21H16O8","C12415","582805"
"Neostigmine","C12H19N2O2+","C07258","9467"
"124-1","C37H44O14","C12409","582799"
"Imidazole","C3H4N2","C01589","4744"
"Stemmadenine","C21H26N2O3","C11691","13856"
"Epibatidine","C11H13ClN2","C11690","13855"
"Trapidil","C10H15N5","C12620","583010"
"trans-3-Hydroxycinnamate","C9H8O3","C12621","583011"
"Fezatione","C17H14N2S2","C12618","583008"
"Hentriacontane-14,16-dione","C31H60O2","C08377","10573"
"2-Hydroxy-6-ketononatrienedioate","C9H8O6","C12624","583014"
"Biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)","C25H24O13","C12625","583015"
"cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol","C9H10O4","C12622","583012"
"trans-2,3-Dihydroxycinnamate","C9H8O4","C12623","583013"
"Diallyl sulfide","C6H10S","C08370","10566"
"Kaempferol 3-O-beta-D-galactoside","C21H20O11","C12626","583016"
"Apigenin 7-O-neohesperidoside","C27H30O14","C12627","583017"
"Imperialine","C27H43NO3","C10808","12991"
"Dimethyl disulfide","C2H6S2","C08371","10567"
"Germine","C27H43NO8","C10807","12990"
"Galactose","C6H12O6","C01582","4738"
"Irehine","C23H39NO","C10810","12993"
"GDPhexose","C16H25N5O16P2","C01581","4737"
"5-Pentadecylresorcinol","C21H36O2","C10809","12992"
"3-(2-Aminoethyl)-1H-indol-5-ol","C10H12N2O","C00780","4041"
"Arsonoacetate","C2H5AsO5","C06550","8779"
"Tropinone","C8H13NO","C00783","4042"
"Jervine","C27H39NO3","C10811","12994"
"1,2,3-Trichlorobenzene","C6H3Cl3","C14408","149899"
"2,3-Dioxo-L-gulonate","C6H8O7","C04575","7176"
"2-Hydroxydibenzofuran","C12H8O2","C14409","208673"
"di-trans,poly-cis-Undecaprenyl diphosphate","C55H92O7P2","C04574","7175"
"Pepstatin","C34H63N5O9","C00773","4035"
"15-Oxo-5,8,11-cis-13-trans-eicosatetraenoate","C20H30O3","C04577","7178"
"Phloretin","C15H14O5","C00774","4036"
"1,2,3,4,6-Pentakis-O-galloyl-beta-D-glucose","C41H32O26","C04576","7177"
"L-Idonate","C6H12O7","C00770","4032"
"D-myo-Inositol 1,2,4,5,6-pentakisphosphate","C6H17O21P5","C04563","7166"
"Mevaldate","C6H10O4","C00772","4034"
"Benzyl (2S,3S)-2-methyl-3-hydroxybutanoate","C12H16O3","C04562","7165"
"UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate","C17H25N3O18P2","C04573","7174"
"Glycopeptide","C36H64N8O17","C00528","3811"
"Glutaryl-CoA","C26H42N7O19P3S","C00527","3810"
"Deoxyuridine","C9H12N2O5","C00526","3809"
"D-Tryptophan","C11H12N2O2","C00525","3808"
"Cytochrome C","C42H52FeN8O6S2","C00524","3807"
"S-(N-Hydroxy-N-methylcarbamoyl)glutathione","C12H20N4O8S","C04572","7173"
"(R)-Pantoate","C6H12O4","C00522","3805"
"(-)-Limonene","C10H16","C00521","3804"
"Hypotaurine","C2H7NO2S","C00519","3802"
"Hexadecanal","C16H32O","C00517","3800"
"Eburicoic acid","C31H50O3","C14495","215652"
"Gibberellin A14 aldehyde","C20H28O4","C11853","14015"
"Zinc gluconate","C12H22O14Zn","C11852","14014"
"N-Methyl-L-alanine","C4H9NO2","C02721","5683"
"Cyclo(L-Phe-L-Pro)","C14H16N2O2","C11847","14009"
"Cyclo(deltaAla-L-Val)","C8H12N2O2","C11846","14008"
"N-(3-Hydroxy-7-cis-tetradecenoyl)homoserine lactone","C18H31NO4","C11845","14007"
"N-Heptanoylhomoserine lactone","C11H19NO3","C11844","14006"
"Zn-Bacterio-chlorophyll a","C55H74N4O6Zn","C11851","14013"
"Divinylchlorophyll a","C55H70MgN4O5","C11850","14012"
"3-Hydroxy-palmitic acid methyl ester","C17H34O3","C11849","14011"
"2-Heptyl-3-hydroxy-quinolone","C16H21NO2","C11848","14010"
"Urocanate","C6H6N2O2","C00785","4043"
"Vestitone","C16H14O5","C00786","4044"
"Belladine","C19H25NO3","C08518","10711"
"Fludrocortisone acetate","C23H31FO6","C08186","10386"
"3-Oxohexulose 6-phosphate","C6H13O9P","C06019","8291"
"Dimethisterone","C23H32O2","C07628","9830"
"17alpha-Dihydroequilenin","C18H20O2","C14498","165712"
"D-Arabinonate","C5H10O6","C00878","4134"
"Crotonoyl-CoA","C25H40N7O17P3S","C00877","4133"
"2-Oxooctadecanoic acid","C18H34O3","C00869","4126"
"Pantothenate","C9H17NO5","C00864","4121"
"Methanofuran","C34H44N4O15","C00862","4119"
"L-Rhamnulose","C6H12O5","C00861","4118"
"Coenzyme F420","C29H36N5O18P","C00876","4132"
"Angiotensin I","C63H91N17O13","C00873","4130"
"Aminomalonate","C3H5NO4","C00872","4129"
"4-Nitrophenol","C6H5NO3","C00870","4127"
"(1)-3-Hydroxybutyric acid","C4H8O3","","152509"
"N-(3-Amino-4-chlorophenyl)acetamide","C8H9ClN2O","","681431"
"Trimethylacetyl phosphate","C5H11O5P","","657017"
"2-Acetamidopropionic acid","C5H9NO3","","150408"
"(1)-(3-Amino-3-carboxypropyl)dimethylsulphonium iodide","C6H14INO2S","","3886671"
"2-Morpholinoethylamine","C6H14N2O","","203809"
"1,3,4-THIADIAZOLE, 2-AMINO-5-ETHYL-","C4H7N3S","","169177"
"(Aminophenylmethyl)phosphonic acid","C7H10NO3P","","675736"
"(S)-2-Amino-4-(methylseleno)butanoic acid","C5H11NO2Se","","682499"
"5-Acetamido-2-nitrobenzoic acid","C9H8N2O5","","655125"
"8-Oxocoformycin","C11H14N4O5","C02243","5306"
"Anthranilyl-CoA","C28H41N8O17P3S","C02247","5310"
"Angiotensin II","C57H80N16O12","C02135","5214"
"Benzoylagmatine","C12H18N4O","C02253","5316"
"Cycloeucalenol","C30H50O","C02141","5220"
"D-threo-Aldose","C4H8O4","C02143","5222"
"Chlorophyllide","C35H34MgN4O5","C02139","5218"
"Corticosterone","C21H30O4","C02140","5219"
"D-Glucose oxime","C6H13NO6","C02264","5325"
"D-Phenylalanine","C9H11NO2","C02265","5326"
"Dihydrolipoate","C8H16O2S2","C02147","5225"
"Formylpyruvate","C4H4O4","C02150","5227"
"N-Hydroxyarylamine","C6H7NO","C02720","5682"
"L-Normetanephrine","C9H13NO3","C05589","7914"
"Tabernanthine","C20H26N2O","C09274","11465"
"Luvangetin","C15H14O4","C09273","11464"
"Herniarin","C10H8O3","C09268","11459"
"Heliettin","C19H22O4","C09267","11458"
"Fraxin","C16H18O10","C09266","11457"
"Fraxetin","C10H8O5","C09265","11456"
"Libanorin","C19H20O5","C09272","11463"
"Leptodactylone","C11H10O5","C09271","11462"
"Isosamidin","C21H22O7","C09270","11461"
"Imperatorin","C16H14O4","C09269","11460"
"Calyculin A","C50H81N4O15P","C05370","7744"
"2-Dehydro-3-deoxy-L-rhamnonate","C6H10O5","C03979","6696"
"Tautomycin","C41H66O13","C05372","7746"
"Microcystin-LR","C49H74N10O12","C05371","7745"
"2-Hydroxy-2-hydropyrone-4,6-dicarboxylate","C7H6O6","C05375","7749"
"N-Acetyl-D-glucosamine 4-sulfate","C8H15NO9S","C05374","7748"
"Menadione","C11H8O2","C05377","7751"
"Biochanin A-beta-D-glucoside","C22H22O10","C05376","7750"
"Oxalosuccinate","C6H6O7","C05379","7753"
"beta-D-Fructose 1,6-bisphosphate","C6H14O12P2","C05378","7752"
"Lacinilene C 7-methyl ether","C16H20O3","C09695","11885"
"Lactaroviolin","C15H14O","C09696","11886"
"3-Hydroxy-4-methylanthranilate","C8H9NO3","C03986","6702"
"3,7-Dimethylocta-1,6-dien-3-ol","C10H18O","C03985","6701"
"Emodin 8-glucoside","C21H20O10","C10345","12531"
"Urocortisol","C21H34O5","C05472","7832"
"Emodin","C15H10O5","C10343","12529"
"Embelin","C17H26O4","C10342","12528"
"Frangulin B","C20H18O9","C10349","12535"
"Macrophylline","C13H21NO3","C10348","12534"
"Lycopsamine","C15H25NO5","C10347","12533"
"Frangulin A","C21H20O9","C10346","12532"
"Sesartemin","C23H26O8","C10884","13067"
"Sesamolinol","C20H20O7","C10883","13066"
"Geranylbenzoquinone","C16H20O2","C10351","12537"
"Monocrotaline","C16H23NO6","C10350","12536"
"11beta,21-Dihydroxy-3,20-oxo-5beta-pregnan-18-al","C21H30O5","C05473","7833"
"3alpha,11beta,21-Trihydroxy-20-oxo-5beta-pregnan-18-al","C21H32O5","C05474","7834"
"N-Methylphenylethanolamine","C9H13NO","C03711","6479"
"N-Benzyloxycarbonylglycine","C10H11NO4","C03710","6478"
"Androsterone","C19H30O2","C00523","3806"
"Bis(2-ethylhexyl)phthalate","C24H38O4","C03690","6464"
"7-O-Methylsterigmatocystin","C19H14O6","C03686","6461"
"D-Mannose 1,6-bisphosphate","C6H14O12P2","C03693","6467"
"CMP-N-glycoloylneuraminate","C20H31N4O17P","C03691","6465"
"Dithioerythritol disulfide","C8H18O4S4","C03698","6470"
"D-Pantetheine 4'-phosphate","C11H23N2O7PS","C03694","6468"
"N-Adenylyl-L-phenylalanine","C19H23N6O8P","C03709","6477"
"L-5-Carboxymethylhydantoin","C5H6N2O4","C03703","6473"
"Memantine","C12H21N","C13736","586325"
"Selfotel","C7H14NO5P","C13735","586324"
"Auriculine","C31H45NO8","C10280","12466"
"4-Prenyldihydropinosylvin","C19H22O2","C10281","12467"
"O-7-Angelylheliotridine","C13H19NO3","C10278","12464"
"Angularine","C18H25NO6","C10279","12465"
"Pinosylvin methyl ether","C15H14O2","C10276","12462"
"Anacrotine","C18H25NO6","C10277","12463"
"Phyllodulcin","C16H14O5","C10274","12460"
"Piceid","C20H22O8","C10275","12461"
"Orchinol","C16H16O3","C10272","12458"
"Oxyresveratrol","C14H12O4","C10273","12459"
"LY382884","C18H23NO4","C13730","586319"
"11-Methoxy-vinorine","C22H24N2O3","C12073","14225"
"Tetraphyllicine","C20H24N2O","C12075","14226"
"Pulvomycin","C47H66O13","C12070","14223"
"Iodoquinol","C9H5I2NO","C07636","9838"
"GE2270A","C56H55N15O10S6","C12068","14221"
"3-Hydroxypropenoate","C3H4O3","C12069","14222"
"Valnemulin","C31H52N2O5S","C12066","14219"
"2-Deoxy-2-dimethylamino-alpha-D-Glucose","C8H17NO5","C12067","14220"
"Pinacidil","C13H21N5O","C13729","586318"
"Triethylenemelamine","C9H12N6","C07642","9844"
"Thiotepa","C6H12N3PS","C07641","9843"
"Pheophytins","C56H76N4O6","C05797","8092"
"Bacterio-pheophytins","C56H78N4O6","C05798","8093"
"L-Urobilinogen","C33H48N4O6","C05789","8084"
"I-Urobilinogen","C33H44N4O6","C05790","8085"
"(3Z)-Phycocyanobilin","C33H38N4O6","C05786","8081"
"Bilirubin beta-diglucuronide","C45H52N4O18","C05787","8082"
"I-Urobilin","C33H42N4O6","C05794","8089"
"D-Urobilin","C33H40N4O6","C05795","8090"
"D-Urobilinogen","C33H42N4O6","C05791","8086"
"L-Urobilin","C33H46N4O6","C05793","8088"
"Dyclonine","C18H27NO2","C07881","10083"
"Ursodiol","C24H40O4","C07880","10082"
"Clomiphene","C26H28ClNO","C06917","9134"
"Clofibrate","C12H15ClO3","C06916","9133"
"Clemastine","C21H26ClNO","C06913","9130"
"Difenoxin","C28H28N2O2","C07871","10073"
"Clofazimine","C27H22Cl2N4","C06915","9132"
"Clindamycin","C18H33ClN2O5S","C06914","9131"
"Chlorthalidone","C14H11ClN2O4S","C06908","9125"
"Chlorpropamide","C10H13ClN2O3S","C06907","9124"
"Cisapride","C23H29ClFN3O4","C06910","9127"
"Cidofovir","C8H14N3O6P","C06909","196891"
"Soyasaponin II","C47H76O17","C12081","14232"
"Esatenolol","C14H22N2O3","C12918","583307"
"Phenylpropanol","C9H12O","C12917","583306"
"Flumetasone pivalate","C27H36F2O6","C12911","583300"
"Bolandiol dipropionate","C24H36O4","C12908","583297"
"Nemonapride","C21H26ClN3O2","C12915","583304"
"Ethenzamide","C9H11NO2","C12913","583302"
"Isopropyl unoprostone","C25H44O5","C12899","583288"
"Carpipramine maleate","C32H42N4O5","C12896","583285"
"Variotin","C17H25NO3","C12905","583294"
"Tetragastrin","C37H42N6O8S","C12903","583292"
"Sorbitol 6-phosphate","C6H15O9P","C01096","4331"
"D-Tagatose 6-phosphate","C6H13O9P","C01097","4332"
"Dihydrofolate","C19H21N7O6","C00415","3705"
"cis-Aconitate","C6H6O6","C00417","3707"
"Methanethiol","CH4S","C00409","3699"
"Progesterone","C21H30O2","C00410","3700"
"16alpha-Hydroxysteroid","C19H32O2","C01090","4325"
"Deacetylvindoline","C23H30N2O5","C01091","4326"
"L-Aspartyl-L-phenylalanine","C13H16N2O5","","670029"
"Glycoursodeoxycholic acid","C26H43NO5","","670344"
"L-Cysteinylglycine disulfide","C8H15N3O5S2","","750000"
"Hydroxyoctanoic acid","C8H16O3","","265828"
"(R)-Mevalonate","C6H12O4","C00418","3708"
"trans-Cinnamate","C9H8O2","C00423","3713"
"L-Fuculose 1-phosphate","C6H13O8P","C01099","4333"
"L-Histidinol phosphate","C6H12N3O4P","C01100","4334"
"Aspidofractine","C22H26N2O3","C09040","11232"
"Aspidospermatine","C21H26N2O2","C09041","11233"
"Aspidoalbine","C24H32N2O5","C09038","11230"
"Aspidodasycarpine","C21H26N2O4","C09039","11231"
"(-)-Apparicine","C18H20N2","C09036","11228"
"Aricine","C22H26N2O4","C09037","11229"
"Apodine","C21H22N2O4","C09034","11226"
"Apovincamine","C21H24N2O2","C09035","11227"
"Aspidospermine","C22H30N2O2","C09042","11234"
"Auricularine","C33H42N4","C09043","11235"
"D-Xylose","C5H10O5","C00181","3481"
"Glycogen","C24H42O21","C00182","3482"
"Hydroxypyruvate","C3H4O4","C00168","3468"
"Carbamoyl phosphate","CH4NO5P","C00169","3469"
"Phenylpyruvate","C9H8O3","C00166","3466"
"UDPglucuronate","C15H22N2O18P2","C00167","3467"
"Agmatine","C5H14N4","C00179","3479"
"Benzoate","C7H6O2","C00180","3480"
"5'-Methylthioadenosine","C11H15N5O3S","C00170","3470"
"Thymine","C5H6N2O2","C00178","3478"
"trans-Cyclohexane-1,2-diol","C6H12O2","C03739","6502"
"(S)-4-Amino-5-oxopentanoate","C5H9NO3","C03741","6504"
"11alpha-Hydroxyprogesterone","C21H30O3","C03747","6508"
"(S)-Dihydroorotate","C5H6N2O4","C00337","3630"
"16alpha-Hydroxyprogesterone","C21H30O3","C03748","6509"
"Tectochrysin","C16H12O4","C11621","13786"
"Aldohexose 6-phosphate","C6H13O9P","C03251","6118"
"4,8-Dihydroxyquinoline","C9H7NO2","C05637","7948"
"(S)-1-Pyrroline-5-carboxylate","C5H7NO2","C03912","6642"
"(S)-beta-Methylindolepyruvate","C12H11NO3","C03914","6643"
"3-Hydroxykynurenamine","C9H12N2O2","C05636","7947"
"Quercetin 3,4',7-trissulfate","C15H10O16S3","C03898","6630"
"S-(4-Bromophenyl)-L-cysteine","C9H10BrNO2S","C03900","6632"
"Propane-1,2-diol 1-phosphate","C3H9O5P","C03894","6626"
"Quercetin 3,3',7-trissulfate","C15H10O16S3","C03897","6629"
"trans-5-O-Caffeoyl-D-quinate","C16H18O9","C03908","6638"
"5-Hydroxyindoleacetate","C10H9NO3","C05635","7946"
"Thiomorpholine 3-carboxylate","C5H9NO2S","C03901","6633"
"beta-L-Arabinose 1-phosphate","C5H11O8P","C03906","6637"
"Fenuron","C9H12N2O","C11224","13403"
"5-Hydroxyindoleacetaldehyde","C10H9NO2","C05634","7945"
"Ferbam","C9H18FeN3S6","C11223","13402"
"5-(3'-Carboxy-3'-oxopropenyl)-4,6-dihydroxypicolinate","C10H7NO7","C05641","7952"
"Fenarimol","C17H12Cl2N2O","C11226","13405"
"Isoferulic acid","C10H10O4","C10470","12653"
"L-Rhamnulose 1-phosphate","C6H13O8P","C01131","4362"
"Herbimycin","C30H42N2O9","C11225","13404"
"Spinosyn B","C40H63NO10","C11055","13237"
"Spinosyn D","C42H67NO10","C11056","13238"
"D-Mycinose","C8H16O5","C11913","14075"
"Clionasterol","C29H50O","","254600"
"26-Hydroxy-24-epi-brassinolide","C28H48O7","C11051","13233"
"7-Ethoxycoumarin","C11H10O3","C11052","13234"
"9,10-Dihydrokadsurenone","C21H26O5","C11053","13235"
"Isosafrole","C10H10O2","C10472","12655"
"3-Acetyl-1-tigloylazadirachtinin","C35H44O16","C11047","13229"
"Brassicanal A","C10H9NOS","C11048","13230"
"24-epi-Brassinolide","C28H48O6","C11049","13231"
"25-Hydroxy-24-epi-brassinolide","C28H48O7","C11050","13232"
"Jionoside B1","C37H50O20","C10473","12656"
"Gracillin","C45H72O17","C08901","11094"
"N-Methylpyridinium","C6H8N+","C02724","5686"
"Geldanamycin","C29H40N2O9","C11222","13401"
"Lusitanicoside","C21H30O10","C10474","12657"
"Deltoside","C51H84O23","C08895","11088"
"Digitogenin","C27H44O5","C08896","11089"
"Convallasaponin A","C32H52O9","C08893","11086"
"Deltonin","C45H72O17","C08894","11087"
"Gitogenin","C27H44O4","C08899","11092"
"Gitonin","C50H82O23","C08900","11093"
"Dioscin","C45H72O16","C08897","11090"
"Diosgenin","C27H42O3","C08898","11091"
"Ancistrocladine","C25H29NO4","C09335","11526"
"Amurine","C19H19NO4","C09334","11525"
"N-Acetyl-D-glucosaminate","C8H15NO7","C01133","4364"
"5-Formyltetrahydrofolate","C20H23N7O7","C03479","6294"
"Adenosine tetraphosphate","C10H17N5O16P4","C03483","6295"
"4-Nitroquinoline N-oxide","C9H6N2O3","C03474","6291"
"5,12-Dihydroxanthommatin","C20H15N3O8","C03476","6293"
"Alangicine","C28H36N2O5","C09327","11518"
"1-(p-Hydroxyphenyl)ethylamine","C8H11NO","C03473","6290"
"Amurensine","C19H19NO4","C09333","11524"
"3-alpha(S)-Strictosidine","C27H34N2O9","C03470","6287"
"Alpinine","C23H29NO6","C09331","11522"
"Alangiside","C25H31NO10","C09330","11521"
"Succinylacetone","C7H10O4","","445300"
"D-Biopterin","C9H11N5O3","",""
"Glucosan","C6H10O5","","272608"
"Dioleoylphosphatidic acid","C39H73O8P","","738554"
"Glucoberteroin","C13H24NO9S3-","C08401","10597"
"Glucoalyssin","C13H24NO10S3-","C08400","10596"
"Glucobrassicanapin","C12H20NO9S2-","C08403","10599"
"Cicutoxin","C17H22O2","C08402","10598"
"Glucocheirolin","C11H20NO11S3-","C08405","10601"
"Glucocapparin","C8H14NO9S2-","C08404","10600"
"Glucocochlearin","C11H20NO9S2-","C08407","10603"
"Glucocleomin","C12H22NO10S2-","C08406","10602"
"9,10-Phenanthroquinone","C14H8O2","C03243","6113"
"beta,gamma-Methylene ATP","C11H18N5O12P3","C13741","586330"
"Adenosine 5-O-(3-thiotriphophate)","C10H16N5O12P3S","C13742","586331"
"(R)-AMAA","C6H8N2O4","C13739","586328"
"alpha,beta-Methylene ATP","C11H18N5O12P3","C13740","586329"
"N-(Tetradecanoyl)-sphing-4-enine","C32H63NO3","C13916","854160"
"N-(30-(9Z,12Z-octadecadienoyloxy)-tricontanoyl)-sphing-4-enine","C66H125NO5","C13918","854162"
"Argiotoxin 636","C29H52N10O6","C13927","854171"
"Hexadecyltrimethylammonium hydroxide","C19H43NO","C13928","854172"
"Argiotoxin 659","C31H53N11O5","C13929","854173"
"JSTX-3","C27H47N7O6","C13931","854175"
"1,7-Dimethylxanthine","C7H8N4O2","C13747","586336"
"9-Methyl-7-bromoeudistomin D","C12H8Br2N2O","C13748","586337"
"Leukotriene F4","C28H44N2O8S","C06462","8694"
"N-Trimethyl-2-aminoethylphosphonate","C5H15NO3P+","C06459","8691"
"D-Altrose","C6H12O6","C06464","8696"
"D-Threose","C4H8O4","C06463","8695"
"D-Idose","C6H12O6","C06466","8698"
"D-Gulose","C6H12O6","C06465","8697"
"D-Psicose","C6H12O6","C06468","8700"
"D-Talose","C6H12O6","C06467","8699"
"Muramic acid","C9H17NO7","C06470","8702"
"Neuraminic acid","C9H17NO8","C06469","8701"
"Levobunolol hydrochloride","C17H26ClNO3","C08228","10427"
"Hydroxocobalamin","C62H90CoN13O15P-2","C08230","10429"
"Levothyroxine sodium anhydrous","C15H10I4NNaO4","C08212","10411"
"Iopanoic acid","C11H12I3NO2","C08217","10416"
"Acetylcholine chloride","C7H16ClNO2","C08201","10400"
"Doxercalciferol","C28H44O2","C08211","10410"
"Meclofenoxate","C12H16ClNO3","C08195","10394"
"Neostigmine bromide","C12H19BrN2O2","C08197","10396"
"Gibberellin A53 aldehyde","C20H28O4","C11905","14067"
"Risedronic acid","C7H11NO7P2","C08233","10432"
"beta-Cymaropyranose","C7H14O4","C08234","10433"
"Dihydromethanophenazine","C37H52N2O","C11904","14066"
"Maprotiline","C20H23N","C07107","9318"
"Mafenide","C7H10N2O2S","C07106","9317"
"6-Keto-prostaglandin F1alpha","C20H34O6","C05961","8245"
"3,6-Dideoxy-3-oxo-dTDP-D-glucose","C16H24N2O15P2","C11908","14070"
"alpha-Oxo-benzeneacetic acid","C8H6O3","C02137","5216"
"Boc-Asn-OPhNO2","C15H19N3O7","C02138","5217"
"6-Keto-prostaglandin E1","C20H32O6","C05962","8246"
"Arachidonyl-CoA","C41H66N7O17P3S","C02249","5312"
"CDPglucose","C15H25N3O16P2","C00501","3784"
"Biliverdin","C33H34N4O6","C00500","3783"
"Erythritol","C4H10O4","C00503","3786"
"D-Xylonate","C5H10O6","C00502","3785"
"(R)-Malate","C4H6O5","C00497","3780"
"Sulochrin","C17H16O7","C00495","3778"
"Allantoate","C4H8N4O4","C00499","3782"
"ADPglucose","C16H25N5O15P2","C00498","3781"
"Castanospermine","C8H15NO4","C02256","5318"
"2,3,6-Trichlorohydroquinone","C6H3Cl3O2","C07099","9310"
"Gentamicin","C21H43N5O7","C00505","3788"
"Folate","C19H19N7O6","C00504","3787"
"Choloyl-taurine","C25H43NO8S","C02258","5320"
"(R)-Canadine","C20H21NO4","C11818","13982"
"Deoxytubulosine","C29H37N3O2","C11817","13981"
"alpha-Methyl-m-tyrosine","C10H13NO3","C11820","13984"
"Cromakalim","C16H18N2O3","C11819","13983"
"2-Aminomalonate semialdehyde","C3H5NO3","C11822","13986"
"5-Hydroxyisourate","C5H4N4O4","C11821","13985"
"13(1)-Hydroxy-magnesium-protoporphyrin IX 13-monomethyl ester","C35H34MgN4O5","C11829","13993"
"3beta-Hydroxy-5beta-pregnane-20-one","C21H34O2","C11825","13989"
"Divinylprotochlorophyllide","C35H30MgN4O5","C11831","13995"
"13(1)-Oxo-magnesium-protoporphyrin IX 13-monomethyl ester","C35H32MgN4O5","C11830","13994"
"D-Galactosamine","C6H13NO5","C02262","5324"
"dTDP-3-amino-3,4,6-trideoxy-D-glucose","C16H27N3O13P2","C11910","14072"
"Xylose","C5H10O5","C01394","4585"
"Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-isoglutaminyl-L-lysyl-(glycyl)5-D-alanyl-D-alanine","C104H172N14O30P2","C05895","8183"
"Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine","C94H157N9O25P2","C05894","8182"
"Bismuth subsalicylate","C7H11BiO4","C07870","10072"
"Haplophyllidine","C18H23NO4","C10692","12875"
"UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysine","C34H55N7O24P2","C05892","8180"
"Glycoperine","C19H21NO8","C10686","12869"
"Glycophymoline","C16H14N2O","C10687","12870"
"Methaqualone","C16H14N2O","C07560","9763"
"Glycosminine","C15H12N2O","C10688","12871"
"dTDP-6-deoxy-D-allose","C16H26N2O15P2","C11912","14074"
"Dibucaine","C20H29N3O2","C07879","10081"
"3a,6b,7b,12a-Tetrahydroxy-5b-cholanoic acid","C24H40O6","",""
"2-Deoxyribonic acid","C5H10O5","",""
"3a,6a,7b-Trihydroxy-5b-cholanoic acid","C24H40O5","","696164"
"3b,7a-Dihydroxy-5b-cholanoic acid","C24H40O4","","742123"
"3-Deoxytetronic acid","C4H8O4","","770103"
"3a,7a-Dihydroxycoprostanic acid","C27H46O4","",""
"3b-Allotetrahydrocorticosterone","C21H34O4","","153881"
"17-Epiestriol","C18H24O3","","121902"
"3b,17b-Dihydroxyetiocholane","C19H32O2","","380005"
"2(R)-Hydroxyadipic acid","C6H10O5","",""
"Methyllycaconitine","C37H50N2O10","C08699","10892"
"Mesaconitine","C33H45NO11","C08698","10891"
"Norerythrostachaldine","C23H37NO5","C08701","10894"
"2-Methylmaleate","C5H6O4","C02226","5291"
"2-Methylbutanal","C5H10O","C02223","5288"
"2-Methylcholine","C6H16NO+","C02224","5289"
"2-Cyanopyridine","C6H4N2","C02221","5286"
"2-Maleylacetate","C6H6O5","C02222","5287"
"Chloroprocaine","C13H19ClN2O2","C07877","10079"
"Ovatine","C24H35NO3","C08703","10896"
"Nudicauline","C38H50N2O11","C08702","10895"
"3-Methylguanine","C6H7N5O","C02230","5294"
"3-Nitroacrylate","C3H3NO4","C02231","5295"
"GDP-6-deoxy-D-mannose","C16H25N5O15P2","C03117","6011"
"Prostaglandin A2","C20H30O4","C05953","8237"
"Prostaglandin B2","C20H30O4","C05954","8238"
"Absinthin","C30H40O6","C09286","11477"
"Pimpinellin","C13H10O5","C09285","11476"
"Acroptilin","C19H23ClO7","C09288","11479"
"3,5-Di-O-galloyl-4-O-digalloylquinic acid","C35H28O22","C10220","12406"
"Alatolide","C19H26O6","C09290","11481"
"Alantolactone","C15H20O2","C09289","11480"
"Ambrosin","C15H18O3","C09292","11483"
"Amaralin","C15H20O4","C09291","11482"
"Anisatin","C15H20O8","C09294","11485"
"Angustibalin","C17H20O5","C09293","11484"
"L-Iduronate 2-sulfate","C6H10O10S","C03126","6019"
"Prostaglandin G2","C20H32O6","C05956","8240"
"Norhyoscyamine","C16H21NO3","C10862","13045"
"Meteloidine","C13H21NO4","C10861","13044"
"Littorine","C17H23NO3","C10860","13043"
"Knightinol","C17H23NO3","C10859","13042"
"Ecgonine","C9H15NO3","C10858","13041"
"Darlingine","C13H17NO2","C10857","13040"
"Convolvine","C16H21NO4","C10856","13039"
"Convoline","C16H21NO5","C10855","13038"
"Testosterone cypionate","C27H40O3","C08156","10356"
"Physoperuvine","C8H15NO","C10864","13047"
"Phyllalbine","C16H21NO4","C10863","13046"
"Prostaglandin J2","C20H30O4","C05957","8241"
"Testosterone enanthate","C26H40O3","C08157","10357"
"delta-12-13,14-Dihydro-prostaglandin J2","C20H30O4","C05958","8242"
"Nandrolone decanoate","C28H44O3","C08154","10354"
"11-epi-Prostaglandin F2alpha","C20H34O5","C05959","8243"
"Oxaloacetate 4-methyl ester","C5H6O5","C03716","6482"
"4,4'-Dihydroxy-3,5-dimethoxydihydrostilbene","C16H18O4","C10256","12442"
"4,7-Dihydroxy-2-methoxy-9,10-dihydrophenanthrene","C15H14O3","C10257","12443"
"Flavidin","C15H12O3","C10258","12444"
"Glepidotin C","C19H22O3","C10259","12445"
"Copalliferol B","C42H32O9","C10252","12438"
"Demethylbatatasin IV","C14H14O3","C10253","12439"
"Dihydropinosylvin","C14H14O2","C10254","12440"
"Dihydroresveratrol","C14H14O3","C10255","12441"
"Gnetin A","C28H22O6","C10260","12446"
"Hircinol","C15H14O3","C10261","12447"
"Mansonone C","C15H16O2","C10371","12557"
"Lucidin omega-methyl ether","C16H12O5","C10370","12556"
"Lactose 6-phosphate","C12H23O14P","C05396","7765"
"Melibiitol","C12H24O11","C05399","7766"
"Platyphylline","C18H27NO5","C10363","12549"
"Kigelinone","C14H10O5","C10362","12548"
"Knipholone","C24H18O8","C10365","12551"
"3-Keto-beta-D-galactose","C6H10O6","C05394","7764"
"beta-Lapachone","C15H14O3","C10367","12553"
"Lapachol","C15H14O3","C10366","12552"
"Lucidin","C15H10O5","C10369","12555"
"Lawsone","C10H6O3","C10368","12554"
"Korupensamine A","C23H25NO4","C12338","582728"
"Dioncopeltine A","C23H25NO4","C12339","582729"
"omega-Cyclohexylundecanoic acid","C17H32O2","C12100","14247"
"Cyclohex-1-enecarboxylic acid","C7H10O2","C12101","14248"
"Cyanidin 3-O-(6-O-p-coumaroyl)glucoside","C30H27O13+","C12095","14243"
"Cyanidin 3-O-(6-O-p-coumaroyl)glucoside-5-O-glucoside","C36H37O18+","C12096","14244"
"Ansatrienin A","C36H48N2O8","C12098","14245"
"Asukamycin","C31H34N2O7","C12099","14246"
"Methylstyrylpyron","C14H12O4","C12090","14239"
"Militarinone C","C26H33NO4","C12335","582725"
"N-Methylanthraniloyl-CoA","C29H43N8O17P3S","C12092","14241"
"1,3-Dihydroxy-N-methyl-acridone","C14H11NO3","C12093","14242"
"cis-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide","C6H3ClO4","C04706","7279"
"alpha-D-Galactosyl-(1,1')-sn-glycerol 3-phosphate","C9H19O11P","C04703","7278"
"2-[3-Carboxy-3-(methylammonio)propyl]-L-histidine","C11H19N4O4+","C04692","7272"
"2-Dehydro-3-deoxy-D-arabino-heptonate 7-phosphate","C7H13O10P","C04691","7271"
"2-(Hydroxymethyl)-3-(acetamidomethylene)succinate","C8H11NO6","C04690","7270"
"(1S,3R,4S)-3,4-Dihydroxycyclohexane-1-carboxylate","C7H12O4","C04687","7268"
"UDPMurAc(oyl-L-Ala-D-gamma-Glu-L-Lys-D-Ala-D-Ala)","C40H65N9O26P2","C04702","7277"
"UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysine","C34H55N7O24P2","C04700","7276"
"Methyl-2-alpha-L-fucopyranosyl-beta-D-galactoside","C13H24O10","C04698","7275"
"5-O-(Indol-3-ylacetyl-myo-inositol) D-galactoside","C22H29NO12","C04695","7273"
"Gyromitrin","C4H8N2O","C08305","10503"
"Medroxyprogesterone acetate","C24H34O4","C08150","10350"
"Paraldehyde","C6H12O3","C07834","10036"
"Ethchlorvynol","C7H9ClO","C07833","10035"
"Fomepizole","C4H6N2","C07837","10039"
"D-glycero-D-manno-Heptose 7-phosphate","C7H15O10P","C07836","10038"
"Ethotoin","C11H12N2O2","C07839","10041"
"D-glycero-D-manno-Heptose 1-phosphate","C7H15O10P","C07838","10040"
"Levetiracetam","C8H14N2O2","C07841","10043"
"Fosphenytoin","C16H15N2O6P","C07840","10042"
"Thiamylal","C12H18N2O2S","C07846","10048"
"Methohexital","C14H18N2O3","C07844","10046"
"Megestrol acetate","C24H32O4","C08151","10351"
"(S)-3-Hydroxy-3-methylglutarate","C6H10O5","C04032","6736"
"1,3,6,8-Naphthalenetetrol","C10H8O4","C04033","6737"
"D-Cathine","C9H13NO","C08300","10498"
"Dimetacrine tartrate","C24H32N2O6","C12959","583348"
"Phenylacetylglycine dimethylamide","C12H16N2O2","C12958","583347"
"Dilazep dihydrochloride","C31H46Cl2N2O10","C12954","583343"
"Mazaticol hydrochloride","C21H28ClNO3S2","C12948","583337"
"Tocoretinate","C49H76O3","C12967","583356"
"Etizolam","C17H15ClN4S","C12965","583354"
"Alminoprofen","C13H17NO2","C12964","583353"
"Cyphenothrin","C24H25NO3","C12962","583351"
"Ethyl piperidinoacetylaminobenzoate","C16H22N2O3","C12970","583359"
"Alfacalcidol","C27H44O2","C12969","583358"
"D-Ribitol 5-phosphate","C5H13O8P","C01068","4307"
"Desulfoglucotropeolin","C14H19NO6S","C01069","4308"
"5-Dehydro-D-gluconate","C6H10O7","C01062","4301"
"6-Carboxyhexanoyl-CoA","C28H46N7O19P3S","C01063","4302"
"Cyclohexane-1,3-dione","C6H8O2","C01066","4305"
"D-Galactose 6-sulfate","C6H12O9S","C01067","4306"
"11beta-Hydroxysteroid","C19H32O2","C01058","4297"
"2,5-Dihydroxypyridine","C5H5NO2","C01059","4298"
"3,5-Diiodo-L-tyrosine","C9H9I2NO3","C01060","4299"
"4-Fumarylacetoacetate","C8H8O6","C01061","4300"
"Hexaporphyrin I","C38H38N4O12","",""
"Hydroxyisocaproic acid","C6H12O3","","432692"
"Isodesmosine","C24H40N5O8+","","157139"
"Methyl N-(a-methylbutyryl)glycine","C8H15NO3","",""
"m-Hydroxymandelic acid","C8H8O4","","298932"
"Methylglutaric acid","C6H10O4","","302103"
"Isovalerylalanine","C8H15NO3","","705841"
"L-3-Phenyllactic acid","C9H10O3","","294770"
"L-Hexanoylcarnitine","C13H25NO4","",""
"Hyocholic Acid","C24H40O5","","391523"
"Tricholomic acid","C5H8N2O4","C08298","10496"
"L-Selenocystathionine","C7H14N2O4Se","C08297","10495"
"2-Hydroxy-6-oxo-(2'-aminophenyl)-hexa-2,4-dienoate","C12H11NO4","C08062","10262"
"5a-Cholestane-3a,7a,12a,23,25-pentol","C27H4805","",""
"Rocuronium","C32H53N2O4+","C07556","9759"
"Narcissidine","C18H23NO5","C12184","14330"
"Saponarin","C27H30O15","C08064","10264"
"Pipecuronium","C35H62N4O4+2","C07554","9757"
"10-Hydroxymorroniside","C17H26O12","C11660","13825"
"Gramine","C11H14N2","C08304","10502"
"Butoconazole nitrate","C19H18Cl3N3O3S","C08066","10266"
"7-Deoxypancratistatin","C14H15NO7","C12255","14400"
"2,3,7,8-Tetrachlorodibenzodioxin","C12H4Cl4O2","C07557","9760"
"Acetoacetamide","C4H7NO2","C11106","13288"
"Econazole nitrate","C18H16Cl3N3O4","C08069","10269"
"Miconazole nitrate","C18H15Cl4N3O4","C08070","10270"
"7-Epiloganic acid","C16H24O10","C11661","13826"
"Galegine","C6H13N3","C08303","10501"
"Naftifine","C21H21N","C08071","10271"
"Ropinirole","C16H24N2O","C07564","9767"
"N-Phenylacetamide","C8H9NO","C07565","9768"
"Falecalcitriol","C27H38F6O3","C13123","585187"
"7-Epiloganin tetraacetate","C25H34O14","C11662","13827"
"Apigenin-6-C-glucoside","C21H20O10","C01714","4851"
"(9E)-Octadecenoic acid","C18H34O2","C01712","4850"
"Hesperetin","C16H14O6","C01709","4847"
"Glyphosate","C3H8NO5P","C01705","4843"
"Inulobiose","C12H22O11","C01711","4849"
"Indan-1-ol","C9H10O","C01710","4848"
"Gibberellin A3","C19H22O6","C01699","4839"
"Galactitol","C6H14O6","C01697","4837"
"Glyceollin","C20H18O5","C01701","4841"
"Globomycin","C32H57N5O9","C01700","4840"
"Adenosine 2',5'-bisphosphate","C10H15N5O10P2","C03850","6587"
"Adenosine 5'-phosphoramidate","C10H15N6O6P","C03851","6588"
"Androstan-3alpha,17beta-diol","C19H32O2","C03852","6589"
"Bis(glycerophospho)-glycerol","C9H22O13P2","C03853","6590"
"Cholesteryl-beta-D-glucoside","C33H56O6","C03855","6591"
"D-Fructosyl-D-fructofuranose","C12H22O11","C03857","6593"
"D-Glucosyldihydrosphingosine","C24H49NO7","C03858","6594"
"Deaminohydroxyblasticidin S","C17H25N7O6","C03860","6596"
"Dibenzo[1,4]dioxin-2,3-dione","C12H6O4","C03861","6597"
"Ethyl (R)-3-hydroxyhexanoate","C8H16O3","C03864","6599"
"Loganin pentaacetate","C27H36O15","C11663","13828"
"Hymexazol  O-glucoside","C10H15NO7","C11102","13284"
"D-Cathinone","C9H11NO","C08301","10499"
"MC-6063","C14H9ClFNO5","C11069","13251"
"2-Deoxystreptamine 4-phosphate","C6H15N2O6P","C03980","6697"
"MC-3761","C14H8Cl3NO5","C11067","13249"
"MC-5127","C15H11Cl2NO5","C11068","13250"
"Benfuracarb","C20H30N2O5S","C11073","13255"
"THTC","C5H8O2S","C11074","13256"
"Aminocarb","C11H16N2O2","C11071","13253"
"4-Carboxy-2-oxo-3-hexenedioate","C7H6O7","C05364","7739"
"Carbetamide","C12H16N2O3","C11075","13257"
"2-N-Dodecyltetrahydrothiophene","C16H32S","C11076","13258"
"10-Deoxygeniposide tetraacetate","C25H32O13","C11664","13829"
"2-Methylpropanal O-methyloxime","C5H11NO","C03982","6699"
"Triacetate lactone","C6H6O3","C02752","5709"
"Sinapoyltartronate","C14H14O9","C02750","5708"
"alpha-Pinene-oxide","C10H16O","C02759","5716"
"D-Xylono-1,4-lactone","C5H8O5","C02753","5710"
"(+)-Pseudoephedrine","C10H15NO","C02765","5721"
"enol-Phenylpyruvate","C9H8O3","C02763","5719"
"1,2-Dihydrosantonin","C15H20O3","C02771","5724"
"(+)-Ureidoglycolate","C3H6N2O4","C02766","5722"
"2,3-Dihydroxyindole","C8H7NO2","C02775","5727"
"10-Hydroxydecanoic acid","C10H20O3","C02774","5726"
"N-Glycolyl-D-glucosamine","C8H15NO7","C03146","6034"
"N-Formyl-L-methionine","C6H11NO3S","C03145","6033"
"1-Aminocyclopentanecarboxylate","C6H11NO2","C03969","6689"
"3-Methoxybenzyl alcohol","C8H10O2","C03352","6193"
"3-Methylthiopropanamine","C4H11NS","C03354","6194"
"3-Phospho-D-erythronate","C4H9O8P","C03356","6195"
"4-Acetamidobutanoyl-CoA","C27H45N8O18P3S","C03357","6196"
"3,5-Dichloro-L-tyrosine","C9H9Cl2NO3","C03347","6189"
"3,6-Dideoxy-L-galactose","C6H12O4","C03348","6190"
"3-Aminopropanesulfonate","C3H9NO3S","C03349","6191"
"3-Hydroxybenzyl alcohol","C7H8O2","C03351","6192"
"Chamissonin","C15H20O4","C09355","11546"
"3-Oxopristanoyl-CoA","C40H70N7O18P3S","C07297","9506"
"7-Deoxygardoside metyl ester tetraacetate","C25H32O13","C11665","13830"
"2,3,4,5-Tetrahydrodipicolinate","C7H9NO4","C03972","6692"
"4-Chloro-2-methylphenol","C7H7ClO","C03359","6197"
"4-Nitrophenyl phosphate","C6H6NO6P","C03360","6198"
"dTDP-3-oxo-4,6-dideoxy-D-glucose","C16H24N2O14P2","C11909","14071"
"Hexose-1,5-lactone","C6H10O6","C02692","5660"
"Methylarsonite","CH5AsO2","C07295","9504"
"Indole-3-acetamide","C10H10N2O","C02693","5661"
"dTDP-D-desosamine","C18H31N3O13P2","C11911","14073"
"L-Formylkynurenine","C11H12N2O4","C02700","5664"
"L-Serine O-sulfate","C3H7NO6S","C02703","5666"
"11-Hydroxyiridodial glucoside pentaacetate","C26H36O13","C11666","13831"
"Monomethyl sulfate","CH4O4S","C02704","5667"
"Mucus glycoprotein","C28H47N5O18","C02705","5668"
"N-Acetoxyarylamine","C8H9NO2","C02709","5672"
"N-Acetyl-L-leucine","C8H15NO3","C02710","5673"
"11beta,17alpha,21-Trihydroxy-5beta-pregnane-3,20-dione","C21H32O5","C05471","7831"
"8-epi-11-Hydroxyiridodial glucoside pentaacetate","C26H36O13","C11667","13832"
"Latifoline","C20H27NO7","C10344","12530"
"Zeaxanthin","C40H56O2","C06098","8363"
"17alpha,21-Dihydroxy-5beta-pregnane-3,11,20-trione","C21H30O5","C05469","7829"
"Urocortisone","C21H32O5","C05470","7830"
"Tectoridin","C22H22O11","C10533","12716"
"Tectorigenin","C16H12O6","C10534","12717"
"(-)-Sparticarpin","C17H16O5","C10531","12714"
"3alpha,7alpha,12alpha-Trihydroxy-5beta-24-oxocholestanoyl-CoA","C48H78N7O21P3S","C05467","7827"
"Sojagol","C20H16O5","C10529","12712"
"Sophoraisoflavanone A","C21H22O6","C10530","12713"
"Sayanedine","C17H14O5","C10527","12710"
"1-(2-Carboxyphenylamino)-1'-deoxy-D-ribulose 5'-phosphate","C12H16NO9P","C10528","12711"
"Rotenonone","C23H18O7","C10525","12708"
"5beta-Cyprinolsulfate","C27H48O8S","C05468","7828"
"Prostaglandin E2","C20H32O5","C00584","3863"
"Taurochenodeoxycholate","C26H45NO6S","C05465","7825"
"2-Deoxy-D-glucose","C6H12O5","C00586","3865"
"Glycochenodeoxycholate","C26H43NO5","C05466","7826"
"GA25","C20H26O6","","745265"
"Angoline","C22H21NO5","C09336","11527"
"GA17","C20H26O7","","743003"
"Ankorine","C19H29NO4","C09337","11528"
"Annolobine","C17H15NO3","C09338","11529"
"1-O-(1Z-Tetradecenyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine","C40H79NO7P+","C13895","854140"
"sn-Caldarchaeo-1-phosphoethanolamine","C88H178NO9P","C13896","854141"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-cytidine-5'-diphosphate","C46H83N3O15P2","C13892","854137"
"1-O-Hexadecyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine","C42H85NO7P+","C13894","854139"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-pyrophosphate","C37H72O11P2","C13890","854135"
"1,2-Didodecanoyl-sn-glycero-3-cytidine-5'-diphosphate","C36H65N3O15P2","C13891","854136"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-1'-myo-inositol","C43H81O13P","C13888","854133"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphate","C37H71O8P","C13889","854134"
"(-)-Apoglaziovine","C18H19NO3","C09340","11531"
"sn-Caldito-1-phosphoethanolamine","C94H190NO15P","C13897","854142"
"1-Palmitoyl-2-(5-hydroxy-8-oxo-6-octenedioyl)-sn-glycero-3-phosphatidylcholine","C32H60NO11P","C13898","854143"
"N-gamma-Acetyldiaminobutyrate","C6H12N2O3","C06442","8676"
"L-Xylulose 1-phosphate","C5H11O8P","C06441","8675"
"2-Dehydro-D-glucono-1,5-lactone","C6H8O6","C06440","8674"
"Prostaglandin E3","C20H30O5","C06439","8673"
"Prostaglandin D1","C20H34O5","C06438","8672"
"5'-Butyrylphosphouridine","C13H19N2O10P","C06436","8670"
"5'-Butyrylphosphoinosine","C14H19N4O9P","C06435","8669"
"5'-Acetylphosphoadenosine","C12H16N5O8P","C06434","8668"
"Atheroline","C19H15NO5","C09343","11534"
"Ulifloxacin","C16H16FN3O3S","C14492","701005"
"2-N,6-N-Bis(2,3-dihydroxy-N-benzoyl)-L-serine","C20H24N2O8","C06446","8679"
"Benzoyldehydro-2,3-dihydroxy-benzone","C13H13NO3","C06444","8678"
"Androdiol","C20H32O2","C14493","84534"
"Clusianose","C12H24O11","C08254","10453"
"Perseitol","C7H16O7","C08255","10454"
"Pyrimidine 5'-deoxynucleotide","C9H15N2O6P","C08249","10448"
"2-O-beta-D-Glucopyranosyl-beta-D-glucopyranose","C12H22O11","C08250","10449"
"Umbelliferose","C18H32O16","C08251","10450"
"beta-D-FructofuranosylO-alpha-D-galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-alpha-D","C30H52O26","C08252","10451"
"6-O-beta-D-Xylopyranosyl-D-glucose","C11H20O10","C08245","10444"
"Robinobiose","C12H22O10","C08246","10445"
"Rutinose","C12H22O10","C08247","10446"
"alpha-D-Galactosyl-(1-6)-alpha-D-galactosyl-(1-6)-beta-D-fructosyl-(2-1)-alpha-D-glucoside","C24H42O21","C08248","10447"
"Threonolactone","C4H6O4","",""
"16-hydroxypalmitate","C16H32O3","","153752"
"Tetrahydroneopterin","C9H15N5O4","","739020"
"3-(3,4-Dihydroxyphenyl)lactate","C9H10O5","C01207","4430"
"Isobavachalcone","C20H20O4","C08648","10841"
"Isobutrin","C27H32O15","C08649","10842"
"Isoliquiritigenin","C15H12O4","C08650","10843"
"Leptosidin","C16H12O6","C08651","10844"
"Hispidol","C15H10O4","C08644","10837"
"(S)-Citramalic acid","C5H8O5","C08645","10838"
"6-Hydroxycyanidin","C15H11O7+","C08646","10839"
"Cyanidin 3-O-galactoside","C21H21O11+","C08647","10840"
"3,5-Dinitro-L-tyrosine","C9H9N3O7","C03225","6097"
"1-Formyl-2-indanone","C10H8O2","C07726","9928"
"Probucol","C31H48O2S2","C07373","9577"
"Procaine","C13H20N2O2","C07375","9579"
"m-Chlorohippuric acid","C9H8NO3","","451026"
"5'-Phosphoribosyl-N-formylglycineamide","C8H15N2O9P","","2057"
"5-Methylthioribulose 1-phosphate","C6H13O7PS","","2263"
"Norcotinine","C9H10N2O","","745077"
"Praziquantel","C19H24N2O2","C07367","9571"
"Porphyrin-ring","C20H16N4","","3091"
"Prednisolone","C21H28O5","C07369","9573"
"Prednisone","C21H26O5","C07370","9574"
"Primidone","C12H14N2O2","C07371","9575"
"Probenecid","C13H19NO4S","C07372","9576"
"Aphidicol-16-ene","C20H32","C11891","14053"
"Aphidicolan-16beta-ol","C20H34O","C11890","14052"
"Neoabietic acid","C20H30O2","C11889","14051"
"L-Pimaric acid","C20H30O2","C11888","14050"
"Abietal","C20H30O","C11887","14049"
"Levopimarinal","C20H30O","C11886","14048"
"Neoabietal","C20H30O","C11885","14047"
"Neoabietinol","C20H32O","C11884","14046"
"Cembrene","C20H32","C11893","14055"
"Aphidicol-15-ene","C20H32","C11892","14054"
"3,4-Dihydroxyphthalate","C8H6O6","C03223","6095"
"Olprinone hydrochloride","C14H11ClN4O","C13546","853911"
"Norcholestenol iodomethyl (131 I)","C27H45IO","C13547","853912"
"Betamethasone butyrate propionate","C29H39FO7","C13535","853902"
"Aldioxa","C4H13AlN4O5","C13536","853903"
"Timiperone","C22H24FN3OS","C13538","853905"
"Lactitol dihydrate","C11H26O13","C13542","853909"
"Secretin","C130H220N44O41","C13523","853892"
"Prochlorperazine mesylate","C22H32ClN3O6S3","C13524","853893"
"Sennoside B","C42H38O20","C13526","853895"
"Tranilast","C18H17NO5","C13530","853898"
"Veratramine","C27H39NO2","C10829","13012"
"2-trans-Dodecenoyl-CoA","C33H56N7O17P3S","C03221","6094"
"11-Keto-testosterone","C19H26O3","C14256","7847066"
"Mibolerone","C20H30O2","C14255","7847065"
"5alpha-Androstan-17beta-ol","C19H32O","C14254","7847064"
"Dibutyl adipate","C14H26O4","C14253","7847063"
"1,3-Dibenzyltetramethyldisiloxane","C18H26OSi2","C14252","7847062"
"1,3-Diphenyltetramethyldisiloxane","C16H22OSi2","C14251","7847061"
"p,p'-Methoxychlor olefin","C16H14Cl2O2","C14250","7847060"
"Norethynodrel","C20H26O2","C14249","7847059"
"p-Cumylphenol","C15H16O","C14258","7847068"
"Methyltrienolone","C19H24O2","C14257","7847067"
"1,3-Dichloro-2-propanol","C3H6Cl2O","C14399","150340"
"Ethylenethiourea","C3H6N2S","C14398","150352"
"3,6,7,12-Tetrahydroxycholan-24-oic acid","C24H40O6","",""
"2-Octenedioic acid","C8H12O4","","220108"
"Benzyl parahydroxybenzoate","C14H12O3","C14393","150220"
"1,3,5,7-Estratetraen-3-ol-17-one","C18H20O2","C14392","153374"
"Diethylstilbestrol dimethyl ether","C20H24O2","C14391","166994"
"Heptanal","C7H14O","C14390","151259"
"Dinitrochlorobenzene","C6H3ClN2O4","C14397","150376"
"Cumene","C9H12","C14396","150471"
"alpha-Methylstyrene","C9H10","C14395","150472"
"4-Nitrotoluene","C7H7NO2","C14394","150545"
"(R)(-)-Allantoin","C4H6N4O3","C02348","5396"
"(S)(+)-Allantoin","C4H6N4O3","C02350","5397"
"trans-Aconitate","C6H6O6","C02341","5390"
"(+)-Norephedrine","C9H13NO","C02343","5392"
"(-)-endo-Fenchol","C10H18O","C02344","5393"
"(2S)-Flavan-4-ol","C15H14O2","C02345","5394"
"Z-Arg-Arg-NHMec","C30H39N9O6","C02334","5384"
"beta-Alanyl-CoA","C24H41N8O17P3S","C02335","5385"
"beta-D-Fructose","C6H12O6","C02336","5386"
"beta-L-Rhamnose","C6H12O5","C02338","5388"
"p-Nitrophenyl-O-ethyl ethylphosphonate","C10H14NO5P","C13048","583437"
"Cyclic ADP-ribose","C15H21N5O13P2","C13050","583439"
"Lynestrenol","C20H28O","C13037","583426"
"Flufenamic acid","C14H10F3NO2","C13038","583427"
"Acemetacin","C21H18ClNO6","C13039","583428"
"Pirfenidone","C12H11NO","C13040","583429"
"Anetholtrithion","C10H8OS3","C13041","583430"
"Exalamide","C13H19NO2","C13042","583431"
"Tricaprilin","C27H50O6","C13044","583433"
"Ethyl linoleate","C20H36O2","C13047","583436"
"2-Hydroxy-3-oxoadipate","C6H8O6","C03217","6090"
"(S)-3-Hydroxyhexadecanoyl-CoA","C37H66N7O18P3S","C05258","7645"
"UDP-alpha-D-galacto-1,4-furanose","C15H24N2O17P2","C03733","6496"
"Cyclopentanol","C5H10O","C02020","5115"
"Cytochrome c1","C47H58FeN4O4S2","C02021","5116"
"Aspulvinone G","C17H12O6","C02007","5103"
"Aspulvinone H","C27H28O5","C02008","5104"
"Benzimidazole","C7H6N2","C02009","5105"
"Blasticidin S","C17H26N8O5","C02010","5106"
"Cellotetraose","C24H42O21","C02013","5109"
"CoA-disulfide","C42H70N14O32P6S2","C02015","5111"
"Cyanopyrazine","C5H3N3","C02018","5113"
"Cyclic ketone","C6H10O","C02019","5114"
"Physovenine","C14H18N2O3","C09232","11423"
"Perlolyrine","C16H12N2O2","C09231","11422"
"Olivacine","C17H14N2","C09230","11421"
"Ochrolifuanine A","C29H34N4","C09229","11420"
"Murrayanine","C14H11NO2","C09228","11419"
"Mitraphylline","C21H24N2O4","C09227","11418"
"Mitragynine","C23H30N2O4","C09226","11417"
"Mesembrinol","C17H25NO3","C09225","11416"
"Quadrigemine A","C44H50N8","C09234","11425"
"Psychotridine","C55H62N10","C09233","11424"
"(-)-Menthyl O-beta-D-glucoside","C16H30O6","C03962","6683"
"Chlorphentermine","C10H14ClN","C07559","9762"
"Oxytetracycline hydrochloride","C22H25ClN2O9","C13055","585120"
"5D-5-O-Methyl-chiro-inositol","C7H14O6","C03844","6581"
"1,8-Diazacyclotetradecane-2,9-dione","C12H22N2O2","C04277","6940"
"1,2-Bis-O-sinapoyl-beta-D-glucoside","C28H32O14","C04275","6938"
"dTDP-4-dehydro-6-deoxy-D-galactose","C16H24N2O15P2","C04269","6933"
"dTDP-4-amino-4,6-dideoxy-D-glucose","C16H27N3O14P2","C04268","6932"
"alpha,alpha'-Trehalose 6-palmitate","C28H52O12","C04265","6930"
"S-(4-Bromophenyl)-mercaptopyruvate","C9H7BrO3S","C04264","6929"
"1,2-Epoxy-3-(p-Nitrophenoxy)propane","C9H9NO4","C04274","6937"
"(S)-Mandelonitrile beta-D-glucoside","C14H17NO6","C04273","6936"
"(R)-2,3-Dihydroxy-3-methylbutanoate","C5H10O4","C04272","6935"
"Proanthocyanidin A2","C30H24O12","C10237","12423"
"5,6beta-Epoxy-5beta-cholestane","C27H46O","C05417","7782"
"Cholesterol-5beta,6beta-epoxide","C27H46O2","C05418","7783"
"Phytofluene","C40H68","C05414","7780"
"5-Cholestene","C27H46","C05416","7781"
"L-Dehydroascorbate","C6H6O6","C05422","7786"
"3beta,5alpha,6beta-Cholestanetriol","C27H48O3","C05425","7789"
"Cholesterol-5alpha,6beta-epoxide","C27H46O2","C05419","7784"
"cis-Phytoene","C40H66","C05421","7785"
"Prenylbenzoquinone","C11H12O2","C10389","12575"
"Senampeline A","C25H31NO8","C10388","12574"
"Phytyl diphosphate","C20H42O7P2","C05427","7791"
"Senaetnine","C20H23NO7","C10386","12572"
"Plastoquinone-9","C53H80O2","C10385","12571"
"Physcion 8-glucoside","C22H22O10","C10384","12570"
"Sarracine","C18H27NO5","C10383","12569"
"Turgorin","C13H15O13S-","C10837","13020"
"4-Hydroxy-3-nitrosobenzamide","C7H6N2O3","C12114","14261"
"Phenacetin","C10H13NO2","C07591","9793"
"Penicillin V","C16H18N2O5S","C08126","10326"
"Celecoxib","C17H14F3N3O2S","C07589","9791"
"Ferroxamine","C25H48FeN6O8+3","C07597","9799"
"Phenazine-1,6-dicarboxylic acid","C14H8N2O4","C12119","14266"
"Pyrethrin I","C21H28O3","C07594","9796"
"dTDP-3-amino-2,3,6-trideoxy-C-methyl-D-erythro-hexopyranos-4-ulose","C17H27N3O13P2","C12319","582709"
"cis-Dihydroquercetin","C15H12O7","C12316","582706"
"Hydroxyprogesterone caproate","C27H40O4","C08148","10348"
"cis-Cyclohexane-1,2-diol","C6H12O2","C12313","582704"
"Succimer","C4H6O4S2","C07598","9800"
"Saphenamycin","C23H18N2O5","C12311","582702"
"Indolin-2-one","C8H7NO","C12312","582703"
"Gibberellin A44","C20H26O5","C12308","582699"
"Esmeraldin B","C38H28N4O7","C12310","582701"
"3alpha,12alpha-Dihydroxy-5beta-cholan-24-oylglycine","C26H43NO5","C04721","7293"
"2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one","C9H9NO5","C04720","7292"
"D-Mannosyl-L-rhamnosyl-D-galactose-1-diphospholipid","C21H40O23P2","C04724","7295"
"3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestanoate","C27H46O5","C04722","7294"
"1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine N-oxide","C12H15NO","C04731","7302"
"trans-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide","C6H3ClO4","C04729","7300"
"4-(4-Deoxy-beta-D-gluc-4-enuronosyl)-D-galacturonate","C12H16O12","C04733","7304"
"4-(1-D-Ribitylamino)-5-amino-2,6-dihydroxypyrimidine","C9H16N4O6","C04732","7303"
"UDP-3-O-(3-hydroxytetradecanoyl)-N-acetylglucosamine","C31H53N3O19P2","C04738","7309"
"1-(5'-Phosphoribosyl)-5-formamido-4-imidazolecarboxamide","C10H15N4O9P","C04734","7305"
"N1-Methyl-4-pyridone-5-carboxamide","C7H8N2O2","C05843","8136"
"5-Glutamyl-taurine","C7H14N2O6S","C05844","8137"
"Nicotinate D-ribonucleoside","C11H14NO6+","C05841","8134"
"N1-Methyl-2-pyridone-5-carboxamide","C7H8N2O2","C05842","8135"
"cis-beta-D-Glucosyl-2-hydroxycinnamate","C15H18O8","C05839","8132"
"Iminoaspartate","C4H5NO4","C05840","8133"
"Glucobrassicin","C16H20N2O9S2","C05837","8130"
"cis-2-Hydroxy cinnamate","C9H8O3","C05838","8131"
"N-Acetyl-D-galactosaminyldiphosphoundecaprenol","C54H87NO12P2","C05845","8138"
"Polyisopentenylpyrophosphate","C5H12O7P2","C05847","8140"
"Fluphenazine enanthate","C29H38F3N3O2S","C07955","10156"
"Chlorprothixene","C18H18ClNS","C07953","10154"
"Chlorpromazine hydrochloride","C17H20Cl2N2S","C07952","10153"
"Acetophenazine maleate","C31H37N3O10S","C07951","10152"
"Tolcapone","C14H11NO5","C07949","10150"
"Entacapone","C14H15N3O5","C07943","10145"
"Biperiden","C21H29NO","C07941","10143"
"Amantadine hydrochloride","C10H18ClN","C07939","10141"
"Sterculic acid","C19H34O2","C08366","10562"
"Tirofiban","C22H36N2O5S","C07965","10166"
"Fluphenazine depot","C32H44F3N3O2S","C07956","10157"
"4'''-Demalonylsalvianin","C39H39O21+","C12641","583031"
"Pelargonidin 3-O-(6-caffeoyl-beta-D-glucoside) 5-O-beta-D-glucoside","C36H37O18+","C12640","583030"
"Quercetin 7-O-beta-D-glucoside","C21H20O12","C12639","583029"
"Quercetin 3-O-(6-O-malonyl-beta-D-glucoside)","C24H22O15","C12638","583028"
"Pelargonidin 3-O-rutinoside 5-O-beta-D-glucoside","C33H41O19+","C12645","583035"
"Pelargonidin 3-O-rutinoside","C27H31O14+","C12644","583034"
"Cyanidin 3-O-(6-O-malonyl-beta-D-glucoside)","C24H23O14+","C12643","583033"
"Pelargonidin 3-O-(6-O-malonyl-beta-D-glucoside)","C24H23O13+","C12642","583032"
"Salvianin","C42H41O24+","C12647","583037"
"Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside","C33H41O20+","C12646","583036"
"Perflutren","C3F8","C13205","585949"
"Cefmenoxime hydrochloride","C32H35ClN18O10S6","C13206","585950"
"Barbital","C8H12N2O3","C13207","585951"
"Riboflavin sodium phosphate","C17H20N4NaO9P","C13082","585146"
"Disopyramide","C21H29N3O","C06965","9179"
"Dipyridamole","C24H40N8O4","C06964","9178"
"Brotizolam","C15H10BrClN4S","C13211","585955"
"Saxitoxin","C10H17N7O4","C13757","586343"
"Digitoxin","C41H64O13","C06955","9170"
"Diethylpropion","C13H19NO","C06954","9169"
"Dihydrotachysterol","C28H46O","C06957","9172"
"Digoxin","C41H64O14","C06956","9171"
"Diphenhydramine","C17H21NO","C06960","9174"
"Diltiazem","C22H26N2O4S","C06958","9173"
"Dipivefrin","C19H29NO5","C06963","9177"
"Diphenidol","C21H27NO","C06961","9175"
"6-Chloro-3,5-diaminopyrazine-3-carboxamide","C8H12ClN7O","C13753","586342"
"Phenylamil","C12H12ClN7O","C13752","586341"
"Benzamil","C13H14ClN7O","C13751","586340"
"Batrachotoxin","C31H42N2O6","C13750","586339"
"Sulmazole","C14H13N3O2S","C13749","586338"
"Isovalerylglycine","C7H13NO3","","269607"
"Ethanolamine phosphate","C2H8NO4P","C00346","3639"
"Methyl-CCNU","C10H18ClN3O2","C07640","9842"
"2-Methyl-3-oxopropanoate","C4H6O3","C00349","3642"
"D-Glucosamine 6-phosphate","C6H14NO8P","C00352","3645"
"Geranylgeranyl diphosphate","C20H36O7P2","C00353","3646"
"D-Fructose 1,6-bisphosphate","C6H14O12P2","C00354","3647"
"3,4-Dihydroxy-L-phenylalanine","C9H11NO4","C00355","3648"
"(S)-3-Hydroxy-3-methylglutaryl-CoA","C27H44N7O20P3S","C00356","3649"
"N-Acetyl-D-glucosamine 6-phosphate","C8H16NO9P","C00357","3650"
"dAMP","C10H14N5O6P","C00360","3651"
"Monodehydroascorbate","C6H7O6 *","C01041","4283"
"N-Acetyl-L-aspartate","C6H9NO5","C01042","4284"
"Diloxanide furoate","C14H11Cl2NO4","C07637","9839"
"4-Nitrophenyl-3-ketovalidamine","C13H16N2O6","C03995","6708"
"Gardneral","C20H22N2O2","C12072","14224"
"Epiandrosterone","C19H30O2","C07635","9837"
"Halofantrine","C26H30Cl2F3NO","C07634","9836"
"Mefloquine","C17H16F6N2O","C07633","9835"
"Androstanediol","C19H32O2","C07632","9834"
"5'-O-beta-D-Glucosylpyridoxine","C14H21NO8","C03996","6709"
"Phosphonomycin","C3H7O4P","C06454","8687"
"Hydroxymethylphosphonate","CH5O4P","C06455","8688"
"2-Hydroxyethylphosphonate","C2H7O4P","C06451","8684"
"Rimantadine","C12H21N","C07236","9445"
"2-Hydroxypropylphosphonate","C3H9O4P","C06452","8685"
"Myxochlin B","C20H27N3O6","C06449","8682"
"5-Hydroxymethyldeoxycytidylate","C10H16N3O8P","C03997","6710"
"Myxochlin C","C27H31N3O9","C06450","8683"
"2-N,6-N-Bis(2,3-dihydroxy-N-benzoyl)-L-serine amide","C20H25N3O7","C06447","8680"
"Myxochlin A","C20H26N2O7","C06448","8681"
"Diallyl disulfide","C6H10S2","C08369","10565"
"Sodium equilin sulfate","C18H19NaO5S","C13416","586158"
"Bz-Arg-OEt","C15H22N4O3","C01670","4815"
"Columbin","C20H22O6","C09077","11269"
"Clerodendrin A","C31H42O12","C09074","11266"
"Clerodin","C24H34O7","C09075","11267"
"Cilastatin","C16H26N2O5S","C01675","4819"
"7beta,12alpha-Dihydroxykaurenolide","C20H28O4","C09081","11273"
"Cotylenin F","C33H54O11","C09078","11270"
"Cyathin A3","C20H30O3","C09079","11271"
"Lucumin","C19H25NO10","C08335","10533"
"Neolinustatin","C17H29NO11","C08336","10534"
"Cysteamine","C2H7NS","C01678","4821"
"Brevicolline","C17H19N3","C09083","11275"
"2-Dehydro-3-deoxy-L-fuconate","C6H10O5","C03827","6570"
"3-Butylidene-7-hydroxyphthalide","C12H12O3","C09921","12107"
"Daphneticin","C20H18O8","C09924","12110"
"2-Dehydro-3-deoxy-D-xylonate","C5H8O5","C03826","6569"
"2,6-Dichlorophenolindophenol sodium salt","C12H6Cl2NNaO2","C03822","6565"
"5,6-Dehydrokawain","C14H12O3","C09925","12111"
"Flossonol","C13H16O3","C09928","12114"
"(S)-3-(Imidazol-5-yl)lactate","C6H8N2O3","C03817","6562"
"Goniothalenol","C13H12O4","C09930","12116"
"Garcinol","C38H50O6","C09929","12115"
"(-)-Laudanidine","C20H25NO4","C09555","11746"
"3-aci-Nitropropanoate","C3H4NO4","C03071","5971"
"2S,5S-Methionine sulfoximine","C5H12N2O3S","C03829","6572"
"3,4-Dehydro-6-hydroxymellein","C10H8O4","C03830","6573"
"4-Bromophenyl acetate","C8H7BrO2","C03076","5974"
"4'-O-Methylisoflavone","C16H12O3","C03074","5973"
"Triamcinolone acetonide","C24H31FO6","C08183","10383"
"Spirasine I","C22H29NO3","C08710","10903"
"Prednisolone tebutate","C27H38O6","C08182","10382"
"Salmeterol","C25H37NO4","C07241","9450"
"4,5-Leukotriene A4","C20H30O3","C02645","5622"
"3-Ureidopropionate","C4H8N2O3","C02642","5621"
"3-Methylbutanamine","C5H13N","C02640","5620"
"Ritonavir","C37H48N6O5S2","C07240","9449"
"3-Fluoro-D-alanine","C3H6FNO2","C02638","5618"
"3-Dehydroshikimate","C7H8O5","C02637","5617"
"3-Dehydrocarnitine","C7H14NO3+","C02636","5616"
"3-Chloro-L-alanine","C3H6ClNO2","C02635","5615"
"Cabergoline","C26H37N5O2","C08187","10387"
"4-Guanidinobutanal","C5H11N3O","C02647","5624"
"4-Coumaryl alcohol","C9H10O2","C02646","5623"
"Conchosin B","C17H20O6","C09373","11564"
"Capnoidine","C20H17NO6","C09372","11563"
"Capaurine","C21H25NO5","C09371","11562"
"Cancentrine","C36H34N2O7","C09370","11561"
"Calafatimine","C38H40N2O7","C09369","11560"
"Triamcinolone hexacetonide","C30H41FO7","C08185","10385"
"Bulbocapnine","C19H19NO4","C09367","11558"
"Bracteoline","C19H21NO4","C09366","11557"
"Triamcinolone diacetate","C25H31FO8","C08184","10384"
"(+-)-Carnegine","C13H19NO2","C09375","11566"
"Confertiflorin","C17H22O5","C09374","11565"
"Moxalactam","C20H20N6O9S","C07231","9440"
"4-Deoxyerythronic acid","C4H8O4","","113470"
"Sertraline","C17H17Cl2N","C07246","9455"
"Selegiline","C13H17N","C07245","9454"
"7-Ketocholesterol","C27H44O2","","392894"
"a-Muricholic acid","C24H40O5","","3885275"
"5b-Cholestane-3a,7a,12a,23R,25-pentol","C27H48O5","",""
"Diphenoxylate","C30H32N2O2","C07872","10074"
"N-Glycoloyl-neuraminate","C11H19NO10","C03410","6239"
"N-Glycosyl-L-asparagine","C10H18N2O8","C03411","6240"
"Clarithromycin","C38H69NO13","C06912","9129"
"Erythrulose 1-phosphate","C4H9O7P","C03394","6225"
"L-2,3-Diaminopropanoate","C3H8N2O2","C03401","6231"
"Dimethylsulfonioacetate","C4H8O2S","C03392","6223"
"4-Phospho-D-erythronate","C4H9O8P","C03393","6224"
"N-Acetylgalactosaminate","C8H13NO7","C03408","6237"
"N-Formimino-L-aspartate","C5H8N2O4","C03409","6238"
"L-Tyrosine methyl ester","C10H13NO3","C03404","6233"
"N-(L-Arginino)succinate","C10H18N4O6","C03406","6235"
"Buntanine","C20H21NO5","C10653","12836"
"Casimiroin","C12H11NO4","C10654","12837"
"Leukotriene E4","C23H37NO5S","C05952","8236"
"Metoclopramide","C14H22ClN3O2","C07868","10070"
"alpha-Cellobiose","C12H22O11","C06421","8656"
"D-Tyrosine","C9H11NO3","C06420","8655"
"Viomycin","C25H43N13O10","C01540","4701"
"Atalaphylline","C23H25NO4","C10645","12828"
"Lariciresinol","C20H24O6","C10646","12829"
"Pyrrole-2-carboxylate","C5H5NO2","C05942","8227"
"Balfourodinium","C17H22NO4+","C10648","12831"
"20-COOH-Leukotriene B4","C20H30O6","C05950","8234"
"12-Keto-leukotriene B4","C20H30O4","C05949","8233"
"L-erythro-4-Hydroxyglutamate","C5H9NO5","C05947","8231"
"D-4-Hydroxy-2-oxoglutarate","C5H6O6","C05946","8230"
"3-Nitropropanoate","C3H5NO4","C02516","5526"
"Butamben","C11H15NO2","C07875","10077"
"3-Oxohexobarbital","C12H15N2O4+","C02517","5527"
"1,4-Bis(2-ethylhexyl) sulfosuccinate","C20H38O7S","C07874","10076"
"4-Aminosalicylate","C7H7NO3","C02518","5528"
"L-Baikiain","C6H9NO2","C08268","10467"
"(-)-Betonicine","C7H13NO3","C08269","10468"
"L-alpha-Amino-gamma-oxalylaminobutyric acid","C6H10N2O5","C08266","10465"
"L-Azetidine 2-carboxylic acid","C4H7NO2","C08267","10466"
"Kinetin","C10H9N5O","C08272","10471"
"2,5-Dihydrophenylalanine","C9H13NO2","C08273","10472"
"L-Canaline","C4H10N2O3","C08270","10469"
"Coprine","C8H14N2O4","C08271","10470"
"Butenafine hydrochloride","C23H28ClN","C12490","582880"
"Lanoconazole","C14H10ClN3S2","C12489","582879"
"L-Djenkolic acid","C7H14N2O4S2","C08275","10473"
"3-(Methylthio)propionic acid","C4H8O2S","C08276","10474"
"dTDP-5-dimethyl-L-lyxose","C17H28N2O15P2","C12481","582871"
"Coumermycin D","C43H49N3O18","C12480","582870"
"Coumermic acid","C27H21N3O10","C12479","582869"
"Coumeroic acid","C17H14N2O7","C12478","582868"
"Biphenyl-2,3-diol","C12H10O2","C02526","5534"
"Talatizamine","C24H39NO5","C08713","10906"
"Butanoylphosphate","C4H9O5P","C02527","5535"
"Acetylene","C2H2","C01548","4707"
"Agaritine","C12H17N3O4","C01550","4708"
"IACI","C26H27IN6O3","C11600","13765"
"IAARh123","C28H19IN5O5+","C11599","13764"
"Grepafloxacin glucuronide","C25H30FN3O9","C11597","13762"
"FMLP","C21H31N3O5S","C11596","13761"
"E3040 glucuronide","C22H25N3O7S","C11595","13760"
"E3040 sulfate","C16H17N3O4S2","C11594","13759"
"E3040","C16H17N3OS","C11593","13758"
"Diethyl pyrocarbonate","C6H10O5","C11592","13757"
"MC-207,110","C25H30N6O2","C11602","13767"
"LDS-751","C21H23ClN2O4S","C11601","13766"
"Tributyrin","C15H26O6","C13870","854115"
"1,2-Di-(9Z,12Z,15Z-octadecatrienoyl)-3-O-beta-D-galactosyl-sn-glycerol","C45H74O10","C13871","854116"
"4,6-Dihydroxyquinoline","C9H7NO2","C05639","7950"
"Dexamethasone acefurate","C29H33FO8","C13865","854110"
"Dexamethasone beloxil","C29H35FO5","C13866","854111"
"1,2-Di-(9Z,12Z,15Z-octadecatrienoyl)-3-(8-(2E,4Z-decadienoyloxy)-5,6-octadienoyl)-sn-glycerol","C57H88O8","C13867","854112"
"1-Dodecanoyl-2-hexadecanoyl-3-octadecanoyl-sn-glycerol","C49H94O6","C13869","854114"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycerol","C37H70O5","C13861","854106"
"1-O-Hexadecyl-2-(9Z-octadecenoyl)-sn-glycerol","C37H72O4","C13862","854107"
"2,3-Di-O-phytanyl-sn-glycerol","C43H88O3","C13863","854108"
"Fenthion","C10H15O3PS2","C14420","148740"
"Precocene 2","C13H16O3","C09018","11210"
"Ticlopidine","C14H14ClNS","C07140","9349"
"Carfecillin","C23H22N2O6S","C11752","13917"
"Talampicillin","C24H23N3O6S","C11751","13916"
"Kaur-16-en-18-al","C20H30O","C11873","14035"
"Kaur-16-en-18-ol","C20H32O","C11872","14034"
"5-Hydroxythiophene-2-carbonyl-CoA","C26H38N7O18P3S2","C07348","9555"
"3'-Demethylstaurosporine","C27H24N4O3","C07349","9556"
"Salvarsan","C12H14As2Cl2N2O2","C11744","13909"
"SB 243213","C22H19F3N4O2","C11743","13908"
"SB 228357","C22H17F4N3O2","C11742","13907"
"SB 221284","C16H14F3N3OS","C11741","13906"
"Pivampicillin","C22H29N3O6S","C11750","13915"
"Penicillin T","C16H19N3O4S","C11749","13914"
"Flucloxacillin","C19H17ClFN3O5S","C11748","13913"
"Succinyl sulfathiazole","C13H13N3O5S2","C11745","13910"
"Paclitaxel","C47H51NO14","C07394","9598"
"Thiourea","CH4N2S","C14415","149010"
"Triphenyltin chloride","C18H15ClSn","C14413","155864"
"Tolazoline","C10H12N2","C07147","9356"
"zeta-Carotene","C40H60","C05430","7794"
"Torulene","C40H54","C08613","10806"
"Isoterchebin","C41H30O27","C10232","12418"
"4-Hydroxy-3,5-dichlorobiphenyl","C12H8Cl2O","C14371","213003"
"2-Hydroxy-3,5-dichlorobiphenyl","C12H8Cl2O","C14370","164170"
"4-Hydroxy-2,2',3',4',5'-pentachlorobiphenyl","C12H5Cl5O","C14373",""
"2-Hydroxy-2',3',4',5,5'-pentachlorobiphenyl","C12H5Cl5O","C14372","696214"
"2,2',3',5',6'-Pentachloro-4-biphenylol","C12H5Cl5O","C14375","841821"
"4-Hydroxy-2,2',3',4',6'-pentachlorobiphenyl","C12H5Cl5O","C14374","755137"
"2',3,3',4',5'-Pentachloro-4-biphenylol","C12H5Cl5O","C14377","841818"
"4-Hydroxy-2,2',4',6'-tetrachlorobiphenyl","C12H6Cl4O","C14376","731365"
"2',3,3',5',6'-Pentachloro-4-biphenylol","C12H5Cl5O","C14379","841817"
"2',3,3',4',6'-Pentachloro-4-biphenylol","C12H5Cl5O","C14378","841819"
"Isopiperitenone","C10H14O","C02289","5345"
"L-Carnitinamide","C7H17N2O2+","C02290","5346"
"Glycyrrhizinate","C42H62O16","C02284","5341"
"Hydroxymalonate","C3H4O5","C02287","5343"
"Methylguanidine","C2H7N3","C02294","5350"
"Methylitaconate","C6H8O4","C02295","5351"
"L-Cystathionine","C7H14N2O4S","C02291","5347"
"Latia luciferin","C15H24O2","C02293","5349"
"N-Acetyldiamine","C2H6N2O","C02297","5352"
"N-Acetylindoxyl","C10H9NO2","C02298","5353"
"Glycol salicylate","C9H10O4","C13013","583402"
"1-Naphthylacetic acid","C12H10O2","C13014","583403"
"Edaravone","C10H10N2O","C13008","583397"
"Ioversol","C18H24I3N3O9","C13011","583400"
"Zaltoprofen","C17H14O3S","C13003","583392"
"Liranaftate","C18H20N2O2S","C13006","583395"
"Laureth 4","C14H30O2","C12995","583384"
"Aceclofenac","C16H13Cl2NO4","C13001","583390"
"N2-Acetyl-L-lysine","C8H16N2O3","C12989","583378"
"Montirelin","C17H24N6O4S","C12993","583382"
"Metformin","C4H11N5","C07151","9360"
"2,6-Dichloroindophenol","C12H7Cl2NO2","C00102","3402"
"Tetrahydrofolate","C19H23N7O6","C00101","3401"
"D-Fructose","C6H12O6","C00095","3395"
"sn-Glycerol 3-phosphate","C3H9O6P","C00093","3393"
"D-Glucose 6-phosphate","C6H13O9P","C00092","3392"
"Succinyl-CoA","C25H40N7O19P3S","C00091","3391"
"Propanoyl-CoA","C24H40N7O17P3S","C00100","3400"
"beta-Alanine","C3H7NO2","C00099","3399"
"L-Cysteine","C3H7NO2S","C00097","3397"
"GDPmannose","C16H25N5O16P2","C00096","3396"
"Pyrimidine nucleoside","C9H14N2O4","C03169","6052"
"Oxidized trypanothione","C27H47N9O10S2","C03170","6053"
"S-Methyl-L-methionine","C6H14NO2S+","C03172","6054"
"S-Methylthioglycolate","C3H6O2S","C03173","6055"
"S-Succinylglutathione","C14H21N3O9S","C03174","6056"
"Shikimate 3-phosphate","C7H11O8P","C03175","6057"
"Steroid hydroperoxide","C19H32O2","C03176","6058"
"Streptamine phosphate","C6H15N2O7P","C03177","6059"
"Prebetanin","C24H26N2O16S","C08567","10760"
"Portulacaxanthin III","C11H12N2O6","C08566","10759"
"Portulacaxanthin II","C18H18N2O7","C08565","10758"
"Portulacaxanthin I","C14H16N2O7","C08564","10757"
"gamma-Undecalactone","C11H20O2","C08571","10764"
"Tuliposide B","C11H18O9","C08570","10763"
"Vulgaxanthin-II","C14H16N2O8","C08569","10762"
"Vulgaxanthin-I","C14H17N3O7","C08568","10761"
"(S)-Hydroxydecanoyl-CoA","C31H54N7O18P3S","C05264","7651"
"3-Oxododecanoyl-CoA","C33H56N7O18P3S","C05263","7650"
"(S)-3-Hydroxydodecanoyl-CoA","C33H58N7O18P3S","C05262","7649"
"(S)-3-Hydroxytetradecanoyl-CoA","C35H62N7O18P3S","C05260","7647"
"(S)-Hydroxyhexanoyl-CoA","C27H46N7O18P3S","C05268","7655"
"3-Oxooctanoyl-CoA","C29H48N7O18P3S","C05267","7654"
"(S)-Hydroxyoctanoyl-CoA","C29H50N7O18P3S","C05266","7653"
"3-Oxodecanoyl-CoA","C31H52N7O18P3S","C05265","7652"
"Chrysin 5,7-dimethyl ether","C17H14O4","C10029","12215"
"Chrysosplenetin","C19H18O8","C10030","12216"
"O-Carbamoyl-deacetylcephalosporin C","C15H20N4O8S","C06568","8797"
"2-Methylpropanoyl phosphate","C4H9O5P","C03754","6513"
"Cephamycin C","C16H22N4O9S","C06566","8795"
"2-Chloro-1,4-naphthoquinone","C10H5ClO2","C03753","6512"
"Penicillin N","C14H21N3O6S","C06564","8793"
"Azaleatin","C16H12O7","C10022","12208"
"Ventinone A","C17H14O6","C10407","12593"
"Tricrozarin A","C13H10O8","C10406","12592"
"Symphytine","C20H31NO6","C10409","12595"
"Symlandine","C20H31NO6","C10408","12594"
"Supinine","C15H25NO4","C10403","12589"
"Rubiadin","C15H10O4","C10402","12588"
"Tectoquinone","C15H10O2","C10405","12591"
"Sennoside A","C42H38O20","C10404","12590"
"Tussilagine","C10H17NO3","C10411","12597"
"Triangularine","C18H25NO5","C10410","12596"
"Ethyl octanoate","C10H20O2","C12292","14436"
"Isoamyl formate","C6H12O2","C12293","14437"
"Geranyl formate","C11H18O2","C12294","14438"
"Citronellyl formate","C11H20O2","C12295","14439"
"alpha-Amylcinnamaldehyde","C14H18O","C12288","14432"
"Isoamyl isovalerate","C10H20O2","C12289","14433"
"Ethyl isovalerate","C7H14O2","C12290","14434"
"Ethylvanillin","C9H10O3","C12291","14435"
"Isoamyl  acetate","C7H14O2","C12296","14440"
"Cyclohexyl acetate","C8H14O2","C12297","14441"
"8-[(1R,2R)-3-Oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate","C18H30O3","C04780","7344"
"N1-(5-Phospho-alpha-D-ribosyl)-5,6-dimethylbenzimidazole","C14H19N2O7P","C04778","7342"
"D-Galactosyl-3-(N-acetyl-beta-D-galactosaminyl)-L-serine","C17H30N2O13","C04776","7340"
"3-Hydroxy-4-hydroxymethyl-2-methylpyridine-5-carboxylate","C8H9NO4","C04773","7338"
"(S)-2-Amino-3-(3-hydroxy-4-oxo-4H-pyridin-1-yl)propanoate","C8H10N2O4","C04771","7336"
"O-1,4-alpha-L-Dihydrostreptosyl-streptidine 6-phosphate","C14H31N6O11P+2","C04767","7334"
"4-(4-Deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate","C12H16O12","C04761","7329"
"3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestanoyl-CoA","C48H80N7O20P3S","C04760","7328"
"(9Z,11E,14Z)-(13S)-13-Hydroperoxyoctadeca-9,11,14-trienoic acid","C18H30O4","C04785","7348"
"cis-4,5-Dihydroxycyclohexa-1(6),2-diene-1,2-dicarboxylate","C8H8O6","C04783","7346"
"Isosalipurpol","C15H12O5","C06561","8790"
"(-)-Isopiperitenone","C10H14O","C02485","5498"
"Deisopropyldeethylatrazine","C3H4ClN5","C06560","8789"
"Agroclavine","C16H18N2","C09023","11215"
"Diethylstilbestrol","C18H20O2","C07620","9822"
"Quinestrol","C25H32O2","C07619","9821"
"Kavapyrone","C14H16O3","C07611","9813"
"Silymarin","C25H22O10","C07610","9812"
"Nafarelin","C66H83N17O13","C07613","9815"
"Leuprolide","C59H84N16O12","C07612","9814"
"Amphenone B","C16H18N2O","C07616","9818"
"Carbimazole","C7H10N2O2S","C07615","9817"
"Mestranol","C21H26O2","C07618","9820"
"Aminoglutethimide","C13H16N2O2","C07617","9819"
"Berberine chloride","C20H18ClNO4","C12679","583069"
"Acrinol","C18H21N3O4","C12677","583067"
"Quercetin3-O-beta-D-glucosyl-(1->2)-beta-D-glucosyl-(1->2)-beta-D-glucoside","C33H40O22","C12668","583058"
"Quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside","C27H30O17","C12667","583057"
"Penflutizide","C13H18F3N3O4S2","C12670","583060"
"Deslanoside","C47H74O19","C12669","583059"
"Bromazepam","C14H10BrN3O","C12674","583064"
"Tegafur","C8H9FN2O3","C12673","583063"
"Ethiazide","C9H12ClN3O4S2","C12676","583066"
"Benzylhydrochlorothiazide","C14H14ClN3O4S2","C12675","583065"
"5-Pyridoxolactone","C8H7NO3","C06052","8323"
"2-Oxo-3-hydroxy-4-phosphobutanoate","C4H7O8P","C06054","8324"
"(E,E)-Piperoyl-CoA","C33H44N7O19P3S","C02611","5596"
"5-O-Methylvisamminol","C16H18O5","C09016","11208"
"4-Methylene-2-oxoglutarate","C6H6O5","C06035","8307"
"4-Hydroxyphenylethanol","C8H10O2","C06044","8315"
"3-Methoxy-4-hydroxyphenylacetate","C9H10O4","C06045","8316"
"Salidroside","C14H20O7","C06046","8317"
"Stizolobate","C9H9NO6","C06047","8318"
"Stizolobinate","C9H9NO6","C06048","8319"
"2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate","C8H7NO4","C06050","8321"
"Isopyridoxal","C8H9NO3","C06051","8322"
"1-O-Sinapoyl beta-D-glucoside","C17H22O10","C03915","6644"
"Metipranolol","C17H27NO4","C07915","10117"
"Levobunolol","C17H25NO3","C07914","10116"
"Phenylpropanolamine","C9H13NO","C07911","10113"
"Thalidomide","C13H10N2O4","C07910","10112"
"Xylometazoline","C16H24N2","C07913","10115"
"Tetrahydrozoline","C13H16N2","C07912","10114"
"Leflunomide","C12H9F3N2O2","C07905","10107"
"Phendimetrazine","C12H17NO","C07904","10106"
"Sirolimus","C51H79NO13","C07909","10111"
"Mycophenolate mofetil","C23H31NO7","C07908","10110"
"Carnosine","C9H14N4O3","C00386","3676"
"Guanosine","C10H13N5O5","C00387","3677"
"Malonate","C3H4O4","C00383","3673"
"3-Pyridylacetic acid","C7H6NNaO2","","15281"
"Xylitol","C5H12O5","C00379","3669"
"Cytosine","C4H5N3O","C00380","3670"
"Steroid","C19H32O","C00377","3667"
"Thiamin","C12H17N4OS+","C00378","3668"
"5-b-Cholestane-3a ,7a ,12a-triol","C27H48O3","","584956"
"TDP-4-Acetamido-4,6-dideoxy-D-galactose","C18H29N3O15P2","",""
"4-(3-Pyridyl)-3-butenoic acid","C9H9NO2","","585030"
"5'-Hydroxycotinine","C10H12N2O2","","585017"
"cis-Fenpropimorph","C20H33NO","","42906"
"Hydroxybupropion","C13H18NO2","","585033"
"1H-Imidazole-4-ethanamine","C5H9N3","C00388","3678"
"Quercetin","C15H10O7","C00389","3679"
"(R)-Lactate","C3H6O3","C00256","3555"
"D-Gluconic acid","C6H12O7","C00257","3556"
"Isomaltose","C12H22O11","C00252","3551"
"Nicotinate","C6H5NO2","C00253","3552"
"Prephenate","C10H10O6","C00254","3553"
"Riboflavin","C17H20N4O6","C00255","3554"
"Lipoamide","C8H15NOS2","C00248","3547"
"Hexadecanoic acid","C16H32O2","C00249","3548"
"Pyridoxal","C8H9NO3","C00250","3549"
"Chorismate","C10H10O6","C00251","3550"
"S-Acetylphosphopantetheine","C13H25N2O8PS","C03725","6490"
"S-(5-Hydroxy-2-furoyl)-CoA","C26H38N7O19P3S","C03724","6489"
"Streptomycin 3''-phosphate","C21H40N7O15P","C03731","6495"
"S-Carboxymethyl-L-cysteine","C5H9NO4S","C03727","6492"
"Vernolepin","C15H16O5","C09582","11773"
"N2,N5-Dibenzoyl-L-ornithine","C19H20N2O4","C03712","6480"
"Pyridine-2,3-dicarboxylate","C7H5NO4","C03722","6487"
"Magnoflorine","C20H24NO4+","C09581","11772"
"Indanone","C9H8O","C01504","4672"
"Kallidin","C56H85N17O12","C01505","4673"
"L-Iditol","C6H14O6","C01507","4675"
"L-Lyxose","C5H10O5","C01508","4676"
"Flavonol","C15H10O3","C01495","4665"
"Geranial","C10H16O","C01499","4668"
"Geraniol","C10H18O","C01500","4669"
"Guaiacol","C7H8O2","C01502","4671"
"5b-Cholestane-3a,7a,12a,23x,25-pentol","C27H48O5","",""
"5a-Cholestane-3a,7a,12a,25-tetrol","C27H4804","",""
"5Z-Tetradecenoic acid","C14H26O2","",""
"3-Methylglutaconic acid","C6H8O4","","136990"
"L-Xylose","C5H10O5","C01510","4677"
"Loganate","C16H24O10","C01512","4678"
"5-Hydroxyhexanoic acid","C6H12O3","","748267"
"6a,12a-Dihydroxylithocholic acid","C24H40O5","","766563"
"Vermelone","C10H10O3","C01624","4775"
"UDPapiose","C14H22N2O16P2","C01623","4774"
"3-Oxo-delta1-steroid","C19H28O","C02941","5860"
"trans-O-Hydroxybenzylidenepyruvate","C10H8O4","C06203","8453"
"Stachyose","C24H42O21","C01613","4765"
"3-Hydroxycyclohexanone","C6H10O2","C03228","6100"
"Taxifolin","C15H12O7","C01617","4769"
"Tauropine","C5H11NO5S","C01616","4768"
"Thiorphan","C12H15NO3S","C01619","4771"
"Testolate","C19H28O4","C01618","4770"
"Tolrestat","C16H14F3NO3S","C01621","4773"
"Threonate","C4H8O5","C01620","4772"
"Retinyl palmitate","C36H60O2","C02588","5580"
"Propanoylagmatine","C8H18N4O","C02581","5576"
"Phenylgalactoside","C12H16O6","C02578","5573"
"Phenoxyacetyl-CoA","C29H42N7O18P3S","C02577","5572"
"5-Methoxy-N,N-dimethyltryptamine","C13H18N2O","C08309","10507"
"Pentachlorophenol","C6HCl5O","C02575","5570"
"O-Phosphoviomycin","C25H44N13O13P","C02574","5569"
"O-Feruloylquinate","C17H20O9","C02572","5568"
"2-Hydroxy-6-keto-2,4-heptadienoate","C7H8O4","C06210","8458"
"3beta-Hydroxysteroid","C19H32O","C02945","5864"
"Sucrose 6-phosphate","C12H23O14P","C02591","5583"
"Steroid O-sulfate","C18H24O4S","C02590","5582"
"Rutin","C27H30O16","C05625","7941"
"N-Methyltryptamine","C11H14N2","C06213","8460"
"Coumaphos anti-dimer","C28H32Cl2O10P2S2","C11026","13209"
"N-Methylserotonin","C11H14N2O","C06212","8459"
"Felbamate","C11H14N2O4","C07501","9704"
"Fluazifop butyl","C19H20F3NO4","C11029","13212"
"Cellohexaose","C36H62O31","C06217","8463"
"Fagaramide","C14H17NO3","C10455","12638"
"Octanoyl-CoA","C29H50N7O17P3S","C01944","5048"
"Celloheptaose","C42H72O36","C06216","8462"
"[6]-Gingerol","C17H26O4","C10462","12645"
"N-Acetyl-D-phenylalanine","C11H13NO3","C05620","7938"
"Streptomycin","C21H39N7O12","C00413","3703"
"Heteropyrithiamine","C11H13N4+","C02691","5659"
"Ecdysone palmitate","C43H74O7","C02681","5650"
"Cyclohexanone","C6H10O","C00414","3704"
"Dimethyl telluride","C2H6Te","C02677","5647"
"Dihydrobiochanin A","C16H14O5","C02675","5646"
"Dodecanoic acid","C12H24O2","C02679","5649"
"Dodecanedioic acid","C12H22O4","C02678","5648"
"D-Glucuronolactone","C6H8O6","C02670","5641"
"D-Galactonolactone","C6H10O6","C02669","5640"
"Deoxyribonolactone","C5H8O4","C02674","5645"
"Desacetoxyvindoline","C23H30N2O4","C02673","5644"
"D-Ribose 5-diphosphate","C5H12O11P2","C01095","4330"
"8-Amino-7-oxononanoate","C9H17NO3","C01092","4327"
"Cellobiono-1,5-lactone","C12H20O11","C01093","4328"
"Sinapoyl-CoA","C32H46N7O20P3S","C00411","3701"
"Stearoyl-CoA","C39H70N7O17P3S","C00412","3702"
"Bethanechol","C7H17N2O2+","C06850","9068"
"Betaxolol","C18H29NO3","C06849","9067"
"Bisoprolol","C18H31NO4","C06852","9070"
"Bisacodyl","C22H19NO4","C06851","9069"
"Benztropine","C21H25NO","C06846","9064"
"Benzquinamide","C22H32N2O5","C06845","9063"
"Betamethasone","C22H29FO5","C06848","9066"
"Bepridil","C24H34N2O","C06847","9065"
"Eriodictyol","C15H12O6","C05631","7944"
"Bleomycin","C55H84N17O21S3+","C06854","9072"
"Bitolterol","C28H31NO5","C06853","9071"
"Lithocholic acid glycine conjugate","C26H43NO4","","692226"
"Hexanoylglycine","C8H15NO3","","131207"
"Pycnolide","C20H28O6","C09535","11726"
"Pseudoivalin","C15H20O3","C09534","11725"
"D-(1-Aminoethyl)phosphonate","C2H8NO3P","C03782","6533"
"D-Galactosamine 1-phosphate","C6H14NO8P","C03783","6534"
"5beta-Androstane-3,17-dione","C19H28O2","C03772","6526"
"1-Peroxyferolide","C17H22O7","C09526","11717"
"N-Acetyl-D-mannosaminolactone","C8H13NO6","C03776","6529"
"Picrotin","C15H18O7","C09528","11719"
"4-Hydroxyphenylacetaldehyde","C8H8O2","C03765","6521"
"Pleniradin","C15H20O4","C09530","11721"
"4-Oxocyclohexanecarboxylate","C7H10O3","C03767","6523"
"5-Guanidino-2-oxopentanoate","C6H11N3O3","C03771","6525"
"Dihydroxyindole","C8H7NO2","C05664","7974"
"6-Hydroxykynurenate","C10H7NO4","C05663","7973"
"5-Methoxytryptamine","C11H14N2O","C05659","7970"
"Indoxyl","C8H7NO","C05658","7969"
"Homoisocitrate","C7H10O7","C05662","7972"
"5-Methoxyindoleacetate","C11H11NO3","C05660","7971"
"5-(2'-Carboxyethyl)-4,6-dihydroxypicolinate","C9H9NO6","C05655","7966"
"5-(2'-Formylethyl)-4,6-dihydroxypicolinate","C9H9NO5","C05654","7965"
"6-Hydroxyindolelactate","C11H11NO4","C05657","7968"
"5-(3'-Carboxy-3'-oxopropyl)-4,6-dihydroxypicolinate","C10H9NO7","C05656","7967"
"16,17-Didehydropregnenolone","C21H30O2","C06392","8628"
"Thiamin triphosphate","C12H19N4O10P3S","C03028","5933"
"4alpha-Methyl-5alpha-cholest-7-en-3-one","C28H46O","C04453","7080"
"5-Amino-6-(5'-phosphoribitylamino)uracil","C9H17N4O9P","C04454","7081"
"4-Carboxy-2-hydroxyhexa-2,4-dienedioate","C7H6O7","C04451","7078"
"4-Nitrophenol-alpha-D-galactopyranoside","C12H15NO8","C04452","7079"
"N-Acetyl-D-glucosamine 1,6-bisphosphate","C8H17NO12P2","C04461","7086"
"N-Succinyl-2-L-amino-6-oxoheptanedioate","C11H15NO8","C04462","7087"
"6-Phospho-5-dehydro-2-deoxy-D-gluconate","C6H11O9P","C04456","7082"
"Dihydrostreptomycin 6,3''-bis-phosphate","C21H43N7O18P2","C04458","7084"
"Cepharanthine","C37H38N2O6","C09391","11582"
"Cephaeline","C28H38N2O4","C09390","11581"
"Corpaine","C20H19NO6","C09393","11584"
"8-Deoxylactucin","C15H16O4","C09392","11583"
"Dehydrocostus lactone","C15H18O2","C09387","11578"
"Damsin","C15H20O3","C09386","11577"
"(+)-Cassythicine","C19H19NO4","C09389","11580"
"Deoxyelephantopin","C19H20O6","C09388","11579"
"11-Dehydro-thromboxane B2","C20H32O6","C05964","8248"
"Thromboxane B2","C20H34O6","C05963","8247"
"15-HPETE","C20H32O4","C05966","8250"
"(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyicosa-5,8,10,14-tetraenoic acid","C20H32O4","C05965","8249"
"Propinol adenylate","C13H18N5O8P","C05983","8261"
"Propane-1-ol","C3H8O","C05979","8258"
"2-Propyn-1-al","C3H2O","C05985","8263"
"Danielone","C10H12O5","C10674","12857"
"Agrimophol","C26H34O8","C10671","12854"
"2-Propyn-1-ol","C3H4O","C05986","8264"
"Agrimol C","C36H44O12","C10669","12852"
"Evoxine","C18H21NO6","C10670","12853"
"3-Acetyl-6-methoxybenzaldehyde","C10H10O3","C10667","12850"
"Evoxanthidine","C15H11NO4","C10668","12851"
"Echinorine","C11H12NO+","C10665","12848"
"Evoprenine","C20H21NO4","C10666","12849"
"16-alpha-Hydroxypregnenolone","C21H32O3","C06390","8626"
"N-Acetylisoniazid","C8H9N3O2","C07585","9787"
"Algestone","C21H30O4","C06391","8627"
"Fidarestat","C12H10FN3O4","C13314","586058"
"Benalaxyl","C20H23NO3","C10929","13112"
"Fludeoxyglucose (F 18)","C6H11FO5","C13315","586059"
"Fenofibrate","C20H21ClO4","C07586","9788"
"3-Methylbenzaldehyde","C8H8O","C07209","9418"
"Fasoracetam","C10H16N2O2","C13311","586055"
"Felbinac ethyl","C16H16O2","C13313","586057"
"Doranidazole","C8H13N3O6","C13304","586048"
"2-Phytyl-1,4-naphthoquinone","C30H44O2","C13309","586053"
"Modafinil","C15H15NO2S","C13302","586046"
"Salicyluric acid","C9H9NO4","C07588","9790"
"m-Xylene","C8H10","C07208","9417"
"Benziodarone","C17H12I2O3","C13303","586047"
"alpha-Semegma mycolic acid","C77H150O3","C13842","854087"
"17R,18S-Epoxy-5Z,8Z,11Z,14Z-icosatetraenoic acid","C20H30O3","C13843","854088"
"1-Ethyl-2-benzimidazolinone","C9H10N2O","C13840","854085"
"Zoxazolamine","C7H5ClN2O","C13841","854086"
"Octadecanamide","C18H37NO","C13846","854091"
"CP 339818","C21H24N2","C13847","854092"
"DCEBIO","C9H8Cl2N2O","C13844","854089"
"1,3-Di-(octadec-9Z-enoyl)-1-cyano-2-methylene-propane-1,3-diol","C41H71NO4","C13845","854090"
"UK 78282","C29H35NO2","C13848","854093"
"Correolide","C40H52O15","C13849","854094"
"5-Oxohexanoic acid","C6H10O3","C02129","5208"
"4-Oxobutanoate","C4H6O3","C02127","5206"
"Deoxycoformycin","C11H16N4O4","C02267","5328"
"Candoxatril","C29H41NO7","C11722","13887"
"Candoxatrilat","C20H33NO7","C11721","13886"
"Cycloguanil pamoate","C45H44Cl2N10O6","C11724","13889"
"Hexobarbitone","C12H16N2O3","C11723","13888"
"Sulfinpyrazone","C23H20N2O3S","C07317","9525"
"Avizafone","C22H27ClN4O3","C11725","13890"
"Sumatriptan","C14H21N3O2S","C07319","9527"
"Suprofen","C14H12O3S","C07320","9528"
"Temoporfin","C44H32N4O4","C11730","13895"
"Hetacillin","C19H23N3O4S","C11729","13894"
"Ondansetron","C18H19N3O","C07325","9533"
"1,5-Anhydro-D-glucitol","C6H12O5","C07326","9534"
"3-Oxohexanoic acid","C6H10O3","C02122","5201"
"Spiradine A","C20H25NO2","C08708","10901"
"Digalacturonate","C12H18O13","C02273","5333"
"Staphidine","C42H58N2O","C08712","10905"
"Nafoxidine","C29H31NO2","C14212","7847022"
"Butylbenzyl phthalate","C19H20O4","C14211","7847021"
"4-Androstenediol","C19H30O2","C14210","7847020"
"4-Hydroxyestradiol-17beta","C18H24O3","C14209","7847019"
"4,4'-Sulfonyldiphenol","C12H10O4S","C14216","7847026"
"2,4-Dihydroxybenzophenone","C13H10O3","C14215","7847025"
"Dibutyl phthalate","C16H22O4","C14214","7847024"
"Aurin","C19H14O3","C14213","7847023"
"Allocryptopine","C21H23NO5","C02134","5213"
"Octane-1,8-diol","C8H18O2","C14218","7847028"
"1,6-Dimethylnaphthalene","C12H12","C14217","7847027"
"MurAc(oyl-L-Ala-D-gamma-Glu-L-Lys-D-Ala-D-Ala)-diphospho-undecaprenol","C86H143N7O21P2","C04851","7408"
"Vincristine","C46H56N4O10","C07204","9413"
"Tributyl phosphate","C12H27O4P","C14439","173423"
"Captan","C9H8Cl3NO2S","C14438","151763"
"2-Mercaptobenzothiazole","C7H5NS2","C14437","152168"
"Edifenphos","C14H15O2PS2","C14436","170770"
"Benzo(e)pyrene","C20H12","C14435","152319"
"EPN","C14H14NO4PS","C14434","159668"
"Bendiocarb","C11H13NO4","C14433","173597"
"Thiophanate-methyl","C12H14N4O4S2","C14432","174006"
"16-Ketoestrone","C18H20O3","C14441","108475"
"1,4-Dioxane","C4H8O2","C14440","173319"
"Ethyl parahydroxybenzoate","C9H10O3","C13108","585172"
"Hyoscyamine methylbromide","C18H26BrNO3","C13109","585173"
"Propicillin potassium","C18H21KN2O5S","C13110","585174"
"Ancitabin hydrochloride","C9H12ClN3O4","C13112","585176"
"Tibolone","C21H28O2","C13099","585163"
"Hexestrol","C18H22O2","C13101","585165"
"Leucomycin V","C35H59NO13","C13103","585167"
"Aluminoparaaminosalicylate calcium","C14H13AlCaN2O8","C13104","585168"
"Apafant","C22H22ClN5O2S","C13113","585177"
"Adefovir pivoxil","C20H32N5O8P","C13116","585180"
"Clotiapine","C18H18ClN3S","C13056","585121"
"Brassinolide","C28H48O6","C08814","11007"
"Brassicasterol","C28H46O","C08813","11006"
"Ajugalactone","C29H40O8","C08810","11003"
"Spinoside A","C39H56O12","C08809","11002"
"delta5-Avenasterol","C29H48O","C08812","11005"
"Ajugasterone C","C27H44O7","C08811","11004"
"Cucurbitacin S","C30H42O6","C08806","10999"
"Cucurbitacin Q","C32H48O8","C08805","10998"
"Gratiogenin","C30H48O4","C08808","11001"
"11-Deoxocucurbitacin I","C30H44O6","C08807","11000"
"Gliclazide","C15H21N3O3S","C13059","585123"
"3b,7b,12a-Trihydroxy-5b-cholanoic acid","C24H40O5","",""
"CTP","C9H16N3O14P3","C00063","3363"
"Formaldehyde","CH2O","C00067","3367"
"L-Serine","C3H7NO3","C00065","3365"
"Ascorbate","C6H8O6","C00072","3372"
"Thiamin diphosphate","C12H18N4O7P2S","C00068","3368"
"Phosphoenolpyruvate","C3H4O6P-","C00074","3374"
"L-Methionine","C5H11NO2S","C00073","3373"
"L-Ornithine","C5H12N2O2","C00077","3377"
"UTP","C9H15N2O15P3","C00075","3375"
"Histidine","C6H9N3O2","C00768","4030"
"3a,16-Dihydroxyandrostenone","C19H28O3","",""
"7-ketodeoxycholic acid","C24H38O5","","765780"
"3a,7b,12b-Trihydroxy-5b-cholanoic acid","C24H40O5","",""
"3-Hexenedioic acid","C6H8O4","","684776"
"2-Octenoic acid","C8H14O2","","278894"
"Capsorubin","C40H56O4","C08585","10778"
"2,4-Dihydroxypteridine","C6H4N4O2","C03212","6086"
"16-Dehydroprogesterone","C21H28O2","C03207","6083"
"2,2'-Dihydroxybiphenyl","C12H10O2","C03209","6084"
"Crocin","C44H64O24","C08589","10782"
"Crocetin","C20H24O4","C08588","10781"
"1-Hydroxy-2-naphthoate","C11H8O3","C03203","6079"
"alpha-Cryptoxanthin","C40H56O","C08590","10783"
"Eschscholtzxanthin","C40H54O2","C08593","10786"
"Echinenone","C40H54O","C08592","10785"
"2-Amino-3-oxobutanoate","C4H7NO3","C03214","6087"
"2-Carboxy-D-arabinitol","C6H12O7","C03215","6088"
"Hydroxyacetone","C3H6O2","C05235","7630"
"L-3-Aminobutyryl-CoA","C25H43N8O17P3S","C05231","7627"
"3-Hexaprenyl-4,5-dihydroxybenzoate","C37H54O4","C05200","7605"
"5'-Deoxyadenosine","C10H13N5O3","C05198","7603"
"3'-Hydroxy-N-methyl-(S)-coclaurine","C18H21NO4","C05202","7607"
"(R,S)-Tetrahydrobenzylisoquinoline","C16H17N","C05201","7606"
"5,6,8,14-Tetradehydro-3,6-dimethoxy-17-methyl-morphinan-4,7-diol","C19H23NO4","C05220","7619"
"6-O-Methylnorlaudanosoline","C17H19NO4","C05203","7608"
"Phaseollidin","C20H20O4","C05230","7626"
"Phaseollidin hydrate","C20H22O5","C05229","7625"
"Nimetazepam","C16H13N3O3","C13052","585117"
"Nicotinic acid adenine dinucleotide phosphate","C21H27N6O18P3","C13051","583440"
"Acanthicifoline","C10H12N2O2","C09907","12093"
"Ziziphin","C51H80O18","C08991","11183"
"dTDP-L-megosamine","C18H31N3O13P2","C11919","14080"
"1-(5'-Phosphoribosyl)-5-amino-4-(N-succinocarboxamide)-imidazole","C13H19N4O12P","C04823","7384"
"(5Z,9E,11Z,14Z)-(8R)-8-Hydroxyperoxyeicosa-5,9,11,14-tetraenoate","C20H32O4","C04822","7383"
"5-D-(5/6)-5-C-(Hydroxymethyl)-2,6-dihydroxycyclohex-2-en-1-one","C7H10O4","C04815","7377"
"4beta-Hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol","C29H50O2","C04814","7376"
"(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyeicosa-5,8,10,14-tetraenoate","C20H32O4","C04820","7382"
"beta-D-Galactosyl-beta-1,4-N-acetyl-D-glucosaminylglycopeptide","C42H74N8O22","C04819","7381"
"1-(5-Phosphoribosyl)-4-(N-succinocarboxamide)-5-aminoimidazole","C12H20N5O9P","C04811","7373"
"2-Amino-7,8-dihydro-4-hydroxy-6-(diphosphooxymethyl)pteridine","C7H11N5O8P2","C04807","7369"
"1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol 6-phosphate","C7H17N4O7P","C04813","7375"
"1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol 4-phosphate","C7H17N4O7P","C04812","7374"
"Dimethylaminoethyl reserpilinate dihydrochloride","C26H37Cl2N3O5","C13441","586182"
"Estradiol benzoate","C25H28O3","C13444","586185"
"Sulfaphenazole","C15H14N4O2S","C13445","586186"
"Sofalcone","C27H30O6","C13447","586188"
"Bemegride","C8H13NO2","C13448","586189"
"Trichomycin A","C58H84N2O18","C13450","586191"
"Trichomycin B","C58H84N2O18","C13451","853865"
"Exametazime","C13H28N4O2","C12506","582896"
"dTDP-4-oxo-3-methyl-2,6-dideoxy-beta-L-glucose","C17H26N2O14P2","C06623","8849"
"Oxytetracycline","C22H24N2O9","C06624","8850"
"cis-3-Chloroacrylic acid","C3H3ClO2","C06615","8841"
"Erythromycin C","C36H65NO13","C06616","8842"
"dTDP-3-oxo-6-deoxy-alpha-D-glucose","C16H24N2O15P2","C06617","8843"
"dTDP-3-oxo-4,6-dideoxy-alpha-D-glucose","C16H24N2O14P2","C06618","8844"
"dTDP-3-amino-3,4,6-trideoxy-alpha-D-glucose","C16H27N3O13P2","C06619","8845"
"dTDP-3,4-dioxo-2,6-dideoxy-D-glucose","C16H22N2O14P2","C06620","8846"
"dTDP-4-oxo-2,6-dideoxy-alpha-D-glucose","C16H24N2O14P2","C06621","8847"
"dTDP-4-oxo-2,6-dideoxy-L-glucose","C16H24N2O14P2","C06622","8848"
"N-Methyl-D-aspartic acid","C5H9NO4","C12269","14414"
"N-Acetyl-aspartyl-glutamate","C11H16N2O8","C12270","14415"
"Aldrin","C12H8Cl6","C07552","9755"
"Pancuronium","C35H60N2O4+2","C07551","9754"
"(+)-Sceletium A4","C20H24N2O2","C12259","14404"
"(-)-Tortuosamine","C20H26N2O2","C12260","14405"
"(+/-)-Homochelidonine","C21H23NO5","C12257","14402"
"Tubocurarine","C37H41N2O6+","C07547","9750"
"1,2-Dimethoxy-4-[2-(2-propenyloxy)ethenyl]-benzene","C13H16O3","C12263","14408"
"6-(2-Methoxyvinyl)benzo[1,3]dioxole-5-carboxylic acid","C11H10O5","C12264","14409"
"2,3,4-Trioxycyclopentanone","C14H26O4Si","C12261","14406"
"4,4-Disubstituted cyclohexenone","C19H25NO5","C12262","14407"
"O-Palmitoylglycoprotein","C44H77N5O19","C03422","6249"
"2-(4-Chloro-3,5-dimethylphenoxy)-N-(2-phenyl-2H-benzotriazol-5-yl)-acetamide","C22H19ClN4O2","C11561","13726"
"Tesaglitazar","C20H24O7S","C12703","583093"
"Clobetasone butyrate","C26H32ClFO5","C12702","583092"
"Clobetasol propionate","C25H32ClFO5","C12701","583091"
"Bufexamac","C12H17NO3","C12700","583090"
"Carboquone","C15H19N3O5","C12699","583089"
"Cloxazolam","C17H14Cl2N2O2","C12697","583087"
"Floctafenine","C20H17F3N2O4","C12696","583086"
"Difluprednate","C27H34F2O7","C12695","583085"
"Epitiostanol","C19H30OS","C12694","583084"
"Cefacetrile sodium","C13H12N3NaO6S","C12691","583081"
"Methylarsonate","CH5AsO3","C07294","9503"
"ent-Kaurene","C20H32","C06090","8356"
"Abietate","C20H30O2","C06087","8353"
"Aphidicolin","C20H34O4","C06088","8354"
"Tetrahymanol","C30H52O","C06083","8349"
"Pimaradiene","C20H32","C06086","8352"
"Nivalenol","C15H20O7","C06080","8346"
"Abscisate","C15H20O4","C06082","8348"
"Limonene","C10H16","C06078","8344"
"PR-toxin","C17H20O6","C06079","8345"
"Sulcatol","C8H16O","C07288","9497"
"(24R,24'R)-Fucosterol epoxide","C29H48O2","C03910","6640"
"Crepenynate","C18H30O2","C07289","9498"
"Glutamate","C5H9NO4","C00302","3596"
"Glutamine","C5H10N2O3","C00303","3597"
"Quinate","C7H12O6","C00296","3590"
"Uridine","C9H12N2O6","C00299","3593"
"Creatine","C4H9N3O2","C00300","3594"
"ADPribose","C15H24N5O14P2+","C00301","3595"
"Aniline","C6H7N","C00292","3586"
"Glucose","C6H12O6","C00293","3587"
"Inosine","C10H12N4O5","C00294","3588"
"Orotate","C5H4N2O4","C00295","3589"
"Iminoerythrose 4-phosphate","C4H10NO6P","C12215","14360"
"Mycobactin S","C44H69N5O10","C12216","14361"
"Caffeyl alcohol","C9H10O3","C12206","14352"
"p-Coumaroyl quinic acid","C16H18O8","C12208","14353"
"Caffeoyl quinic acid","C16H18O9","C12209","14354"
"UDP-3-ketoglucose","C15H22N2O17P2","C12210","14355"
"UDP-kanosamine","C15H25N3O16P2","C12211","14356"
"Kanosamine","C6H13NO5","C12212","14357"
"Kanosamine 6-phosphate","C6H14NO8P","C12213","14358"
"Aminofructose 6-phosphate","C6H14NO8P","C12214","14359"
"(R)-Mandelamide","C8H9NO2","C07301","9509"
"Fluvoxamine","C15H21F3N2O2","C07571","9774"
"Lomefloxacin hydrochloride","C17H20ClF2N3O3","C08053","10253"
"Cinoxacin","C12H10N2O5","C08052","10252"
"Sulfacetamide sodium anhydrous","C8H9N2NaO3S","C08051","10251"
"Etomidate","C14H16N2O2","C07522","9725"
"Sertindole","C24H26ClFN4O","C07567","9770"
"Ethambutol hydrochloride","C10H26Cl2N2O2","C08058","10258"
"Phenolic steroid","C18H24O","C02453","5473"
"Cycloserine","C3H6N2O2","C08057","10257"
"Ziprasidone","C21H21ClN4OS","C07568","9771"
"Valclavam","C14H23N3O6","C06668","8893"
"3-Methoxy-4-hydroxyphenylglycol glucuronide","C15H20O10","",""
"5,6-Dihydrouridine","C9H14N2O6","","248559"
"7-Hydroxyoctanoic acid","C8H16O3","","745082"
"4E,15Z-Bilirubin IXa","C33H36N4O6","",""
"Allopurinol riboside","C10H12N4O5","","329207"
"5b-Cholestane-3a,7a,12a,23S,25-pentol","C27H48O5","",""
"3-Methylhistidine","C7H11N3O2","","299415"
"7,10-Hexadecadienoic acid","C16H28O2","",""
"7Z,10Z-Hexadecadienoic acid","C16H28O2","",""
"Allodeoxycholic acid","C24H40O4","",""
"Yamogenin","C27H42O3","C08918","11110"
"2,4-Dichlorobenzoyl-CoA","C28H38Cl2N7O17P3S","C06671","8896"
"Hentriacontan-1-ol","C31H64O","C08378","10574"
"Hentriacontan-16-one","C31H62O","C08379","10575"
"Limonoate","C26H34O10","C01593","4748"
"Licodione","C15H12O5","C01592","4747"
"Leupeptin","C20H38N6O4","C01591","4746"
"(Z,Z,Z)-3,6,9-Dodecatrien-1-ol","C12H20O","C08375","10571"
"Hentriacontane","C31H64","C08376","10572"
"Ibuprofen","C13H18O2","C01588","4743"
"Hippurate","C9H9NO3","C01586","4741"
"Hexanoic acid","C6H12O2","C01585","4740"
"Dimethyl trisulfide","C2H6S3","C08372","10568"
"Dipropyl disulfide","C6H14S2","C08373","10569"
"3alpha,12alpha-Dihydroxy-5beta-cholanate","C24H40O4","C04483","7102"
"N2-Succinyl-L-glutamate 5-semialdehyde","C9H13NO6","C05932","8220"
"3-Sulfomuconate","C6H6O7S","C06675","8900"
"Spinosyn A","C41H65NO10","C11054","13236"
"2-Hydroxy-4-(1-oxo-1,3-dihydro-2H-inden-2-ylidene)-but-2-enoic acid","C13H10O4","C07718","9920"
"3,4-Dihydroxyfluorene","C13H10O2","C07717","9919"
"N3'-Acetylneomycin","C25H48N6O14","C02725","5687"
"Mupirocin","C26H44O9","C11758","13922"
"Hecogenin","C27H42O4","C08902","11095"
"Amprotropine","C16H25NO3","C11760","13924"
"Cephaloridine","C19H17N3O4S2","C11754","13918"
"MM13902","C13H16N2O8S2","C11755","13919"
"Miotine","C12H18N2O2","C11763","13927"
"Sarin","C4H10FO2P","C11764","13928"
"Lathodoratin","C11H10O4","C09012","11204"
"Mallotochromene","C24H26O8","C09013","11205"
"Tridihexethyl bromide","C21H36BrNO","C11761","13925"
"N-Feruloyltyramine","C18H19NO4","C02717","5680"
"Drummondin A","C28H34O8","C09004","11196"
"Encecalin","C14H16O3","C09005","11197"
"Eupatoriochromene","C13H14O3","C09006","11198"
"Flindersiachromone","C17H14O2","C09007","11199"
"Frutinone A","C16H8O4","C09008","11200"
"Isobutyrylmallotochromene","C26H30O8","C09009","11201"
"Khellin","C14H12O5","C09010","11202"
"Khellol glucoside","C19H20O10","C09011","11203"
"N-Acetylmuramate","C11H19NO8","C02713","5676"
"N-Methylputrescine","C5H14N2","C02723","5685"
"N-Methylhexanamide","C7H15NO","C02722","5684"
"alpha-D-Xylose 1-phosphate","C5H11O8P","C03737","6500"
"gamma-L-Glutamyl-D-alanine","C8H14N2O5","C03738","6501"
"alpha-D-Hexose 6-phosphate","C6H13O9P","C03735","6498"
"alpha-D-Ribose 5-phosphate","C5H11O8P","C03736","6499"
"(S)-4-Hydroxymandelonitrile","C8H7NO2","C03742","6505"
"1,2,3,5-Tetrahydroxybenzene","C6H6O4","C03743","6506"
"Nitidine","C21H18NO4+","C09595","11786"
"Neopine","C18H21NO3","C09594","11785"
"Narcotoline","C21H21NO7","C09593","11784"
"alpha-Narcotine","C22H23NO7","C09592","11783"
"Narceine","C23H27NO8","C09591","11782"
"(+)-O-Methylthalicberine","C38H42N2O6","C09590","11781"
"(+)-Mecambroline","C18H17NO3","C09589","11780"
"Mecambrine","C18H17NO3","C09588","11779"
"Viscidulin B","C17H22O5","C09587","11778"
"Viguiestenin","C21H28O7","C09586","11777"
"Iridin","C24H26O13","C10465","12648"
"Hellicoside","C29H36O17","C10466","12649"
"Irilone","C16H10O6","C10467","12650"
"Isochlorogenic acid b","C25H24O12","C10468","12651"
"Isoeugenol","C10H12O2","C10469","12652"
"Cinnavalininate","C14H8N2O6","C05640","7951"
"Irisolidone","C17H14O6","C10471","12654"
"5-Hydroxykynurenamine","C9H12N2O2","C05638","7949"
"Butamifos","C13H21N2O4PS","C11022","13205"
"O-Ethyl-O-(5-methyl-4-nitrophenyl)(1-methylpropyl)phosphoramidothioate","C13H21N2O4PS","C11023","13206"
"6-Hydroxymelatonin","C13H16N2O3","C05643","7954"
"Formyl-N-acetyl-5-methoxykynurenamine","C13H16N2O4","C05642","7953"
"Azinphos methyl","C10H12N3O3PS2","C11018","13201"
"Pendimethalin","C13H19N3O4","C11019","13202"
"Diphenylamine","C12H11N","C11016","13199"
"BAS 490 F","C18H19NO4","C11017","13200"
"Parsonsine","C23H37NO7","C10357","12543"
"2-Hydroxymethylanthraquinone","C15H10O3","C10354","12540"
"Cyanidin-3-O-D-rhamnosyl-1,6-D-glucoside","C27H33ClO15","C04491","7110"
"Hypoxylone","C20H12O5","C10355","12541"
"Hibiscoquinone A","C15H14O4","C10352","12538"
"Nemorensine","C18H27NO5","C10353","12539"
"Eremophilenolide","C15H22O2","C09409","11600"
"Eremofrullanolide","C15H20O2","C09408","11599"
"Eremantholide A","C19H24O6","C09407","11598"
"Eremanthin","C15H18O2","C09406","11597"
"Erioflorin methacrylate","C23H28O7","C09413","11604"
"Erioflorin acetate","C21H26O7","C09412","11603"
"Cularine","C20H23NO4","C09411","11602"
"Cularimine","C19H21NO4","C09410","11601"
"Daphnandrine","C36H38N2O6","C09415","11606"
"Eriolangin","C20H28O6","C09414","11605"
"4,5beta-Dihydrocortisone","C21H30O5","C03472","6289"
"Graveoline","C17H13NO3","C10689","12872"
"Megaphone","C22H30O6","C10690","12873"
"Haplodimerine","C28H26N2O6","C10691","12874"
"Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alanine","C94H156N8O26P2","C05893","8181"
"Glycobismine A","C37H34N2O6","C10685","12868"
"Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutaminyl-L-lysyl-(glycyl)5-D-alanyl-D-alanine","C104H172N14O30P2","C05891","8179"
"Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutaminyl-L-lysyl-D-alanyl-D-alanine","C94H157N9O25P2","C05890","8178"
"Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine","C94H156N8O26P2","C05889","8177"
"3-Oxo-4-methylpentanoic acid","C6H10O3","C03467","6286"
"Filixic acid BBB","C36H44O12","C10693","12876"
"Haplopine","C13H11NO4","C10694","12877"
"Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutaminyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine","C95H157N9O27P2","C05899","8187"
"Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine","C95H156N8O28P2","C05898","8186"
"5-Methylthioribose 1-phosphate","C6H13O7PS","","2407"
"3-Methyl-2-oxopentanoate","C6H10O3","C03465","6284"
"Tiglylglycine","C7H11NO3","","747245"
"3-Methyl-vinylacetyl-CoA","C26H42N7O17P3S","C03466","6285"
"Suberylglycine","C10H17NO5","","3746717"
"Epicatechin-(4beta->8)-ent-epicatechin","C30H26O12","C10221","12407"
"Cholesteryl stearate","C45H80O2","","107790"
"Chebulinic acid","C41H32O27","C10215","12401"
"Chebulagic acid","C41H30O27","C10214","12400"
"Casuarinin","C41H28O26","C10213","12399"
"Casuarictin","C41H28O26","C10212","12398"
"Corilagin","C27H22O18","C10219","12405"
"Coriariin A","C82H58O52","C10218","12404"
"Cinchonain 1a","C24H20O9","C10217","12403"
"Daidzin","C21H20O9","C10216","12402"
"alpha-D-Galactosyl-diphosphoundecaprenol","C61H102O12P2","C04507","7121"
"4a-Methyl-5a-cholesta-8,24-dien-3-one","C28H44O","","853831"
"Ketoconazole","C16H9Cl3","","385440"
"Cobalt-precorrin 6","C44H53CoN4O16+","C11542","13709"
"Cobalt-precorrin 5","C45H53CoN4O16+","C11541","13708"
"Cobalt-precorrin 4","C44H51CoN4O16+","C11540","13707"
"Cobalt-precorrin 3","C43H48CoN4O16+","C11539","13706"
"2-(beta-D-Glucosyl)-sn-glycerol","C9H18O8","C11546","13713"
"Cobalt-precorrin 8","C45H59CoN4O14+","C11545","13712"
"2(alpha-D-Mannosyl)-D-glycerate","C9H16O9","C11544","13711"
"Cobalt-dihydro-precorrin 6","C44H55CoN4O16+","C11543","13710"
"1-Carbazol-9-yl-3-(3,5-dimethylpyrazol-1-yl)-propan-2-ol","C20H21N3O","C11560","13725"
"1D-myo-Inositol 1,4,5,6-tetrakisphosphate","C6H16O18P4","C11555","13722"
"2-Indanone","C9H8O","C07727","9929"
"3-Isochromanone","C9H8O2","C07728","9930"
"3-Hydroxy-3-(3-hydroxy-4-methoxyphenyl)propionyl-CoA","C31H46N7O20P3S","C07302","9510"
"4-Hydroxy-3-methoxyphenyl-beta-hydroxypropionyl-CoA","C31H46N7O20P3S","C07303","9511"
"2-Formyl-1-indanone","C10H8O2","C07719","9921"
"3-Hydroxy-1-indanone","C9H8O2","C07720","9922"
"(+)-(3S,4R)-cis-3,4-Dihydroxy-3,4-dihydrofluorene","C13H12O2","C07721","9923"
"3,4-Dihydroxy-3,4-dihydro-9-fluorenone","C13H10O3","C07722","9924"
"4-Hydroxy-9-fluorenone","C13H8O2","C07723","9925"
"1,2-Dihydroxyfluorene","C13H10O2","C07724","9926"
"2-Hydroxy-4-(2-oxo-1,3-dihydro-2H-inden-1-ylidene)but-2-enoic acid","C13H10O4","C07725","9927"
"4,8,12-Trimethyltridecanoyl-CoA","C37H66N7O17P3S","C07296","9505"
"Diprenorphine","C26H35NO4","C11794","13958"
"Etorphine","C25H33NO4","C11793","13957"
"Ketobemidone","C15H21NO2","C11792","13956"
"Bremazocine","C20H29NO2","C11791","13955"
"Phenazocine","C22H27NO","C11790","13954"
"Metazocine","C15H21NO","C11789","13953"
"N-Methyl morphinan","C17H23N","C11788","13952"
"Nalorphine","C19H21NO3","C11787","13951"
"U 50488","C19H26Cl2N2O","C11796","13960"
"Ethylketocyclazocine","C19H25NO2","C11795","13959"
"Musca-aurin-II","C18H16N2O10","C08560","10753"
"4-PIOL","C8H12N2O2","C13710","586299"
"Thio-THIP","C6H8N2OS","C13711","586300"
"3-alpha-Hydroxy-5-alpha-pregnan-20-one","C21H34O2","C13712","586301"
"5-alpha-THDOC","C21H34O3","C13713","586302"
"DNDS","C14H10N2O10S2","C13706","586295"
"RU-0211","C20H32F2O5","C13707","586296"
"IBMX","C10H14N4O2","C13708","586297"
"CPX","C11H16N4O2","C13709","586298"
"alpha-EMGBL","C7H12O2","C13714","586303"
"Miltirone","C19H22O2","C13715","586304"
"Dodecane","C12H26","C08374","10570"
"Urea(13C)","CH4N2O","C13216","585960"
"Idebenone","C19H30O5","C13217","585961"
"Sodium glucuronate","C6H9NaO7","C13085","585149"
"Propagermanium","C6H10Ge2O7","C13086","585150"
"Polaprezinc","C9H11N4O3Zn-","C13071","585135"
"Dexamethasone palmitate","C38H59FO6","C13075","585139"
"Meticrane","C10H13NO4S2","C13065","585129"
"Dimorpholamine","C20H38N4O4","C13067","585131"
"Retinol acetate","C22H32O2","C13081","585145"
"Halopredone acetate","C25H29BrF2O7","C13210","585954"
"Estradiol dipropionate","C24H32O4","C13077","585141"
"Hydrocortisone butyrate","C25H36O6","C13079","585143"
"Vignafuran","C16H14O4","C08993","11185"
"1,1-Dichloro-2,2-bis(4-hydroxyphenyl)ethylene","C14H10Cl2O2","C14238","7847048"
"4-[2,2-Dichloro-1-(4-methoxyphenyl)ethenyl]phenol","C15H12Cl2O2","C14237","7847047"
"4-Hydroxybenzophenone","C13H10O2","C14230","7847040"
"Propanil","C9H9Cl2NO","C14229","7847039"
"4'-Hydroxychalcone","C15H12O2","C14232","7847042"
"4-Hydroxychalcone","C15H12O2","C14231","7847041"
"Dimethylstilbestrol","C16H16O2","C14234","7847044"
"4,4'-Dihydroxystilbene","C14H12O2","C14233","7847043"
"4-Heptyloxyphenol","C13H20O2","C14236","7847046"
"Triphenyl phosphate","C18H15O4P","C14235","7847045"
"Zapoterin","C26H30O8","C08788","10981"
"Undulatone","C27H34O11","C08787","10980"
"Trichilin A","C35H46O13","C08786","10979"
"Toonacilin","C31H38O9","C08785","10978"
"Carnosifloside VI","C48H80O18","C08792","10985"
"Carnosifloside III","C48H78O18","C08791","10984"
"Carnosifloside I","C42H68O13","C08790","10983"
"Bryodulcosigenin","C30H50O4","C08789","10982"
"Cucurbitacin B","C32H46O8","C08794","10987"
"Cucurbitacin A","C32H46O9","C08793","10986"
"2-O-Caffeoylglucarate","C15H16O11","C03062","5962"
"Ethylamine","C2H7N","C00797","4055"
"Dicumarol","C19H12O6","C00796","4054"
"CDPribitol","C14H25N3O15P2","C00789","4047"
"L-Adrenaline","C9H13NO3","C00788","4046"
"Creatinine","C4H7N3O","C00791","4049"
"Citrulline","C6H13N3O3","C00790","4048"
"D-Cysteine","C3H7NO2S","C00793","4051"
"D-Arginine","C6H14N4O2","C00792","4050"
"D-Tagatose","C6H12O6","C00795","4053"
"D-Sorbitol","C6H14O6","C00794","4052"
"UDP-N-acetyl-D-glucosamine","C17H27N3O17P2","C00043","3345"
"Succinate","C4H6O4","C00042","3344"
"L-Alanine","C3H7NO2","C00041","3343"
"Glycine","C2H5NO2","C00037","3339"
"1-Nitropyrene","C16H9NO2","C14421","164414"
"GDP","C10H15N5O11P2","C00035","3337"
"Acetate","C2H4O2","C00033","3335"
"Heme","C34H32FeN4O4","C00032","3334"
"2-Anthramine","C14H11N","C14417","155249"
"3-Amino-1-methyl-5H-pyrido(4,3-b)indole","C12H11N3","C14416","198823"
"2,4-Dichloroaniline","C6H5Cl2N","C14419","154421"
"3-Nitrophenol","C6H5NO3","C14418","154434"
"4-Toluenesulfonamide","C7H9NO2S","C14412","149199"
"Dicyclopentadiene","C10H12","C14411","149455"
"L-Lysine","C6H14N2O2","C00047","3349"
"GTP","C10H16N5O14P3","C00044","3346"
"Lycoricidine","C14H13NO6","C08531","10724"
"Lycorenine","C18H23NO4","C08530","10723"
"Kalbreclasine","C20H23NO12","C08529","10722"
"Hippeastrine","C17H17NO5","C08528","10721"
"Haemanthamine","C17H19NO4","C08527","10720"
"Galanthamine","C17H21NO3","C08526","10719"
"Crinamine","C17H19NO4","C08525","10718"
"Cavinine","C18H21NO6","C08524","10717"
"Narciclasine","C14H13NO7","C08533","10726"
"Lycorine","C16H17NO4","C08532","10725"
"4-Hydroxyphenylacetyl-CoA","C29H42N7O18P3S","C05338","7716"
"Chenodeoxycholoyl-CoA","C45H74N7O19P3S","C05337","7715"
"Selenomethionine","C5H11NO2Se","C05335","7713"
"4'-Methoxy-5,7-dihydroxyflavonone","C16H14O5","C05334","7712"
"Phenethylamine","C8H11N","C05332","7711"
"Homocysteine","C4H9NO2S","C05330","7710"
"D-2-Amino-hexano-6-lactam","C6H12N2O","C05328","7708"
"Nicotianamine","C12H21N3O6","C05324","7705"
"7-O-Acetylsalutaridinol","C21H25NO5","C05322","7704"
"Nororientaline","C18H21NO4","C05317","7699"
"Ketorolac","C15H13NO3","C07062","9274"
"4-Acetamidobutanoate","C6H11NO3","C02946","5865"
"4-Coumaroylshikimate","C16H16O7","C02947","5866"
"6-Amino-2-oxohexanoate","C6H11NO3","C03239","6109"
"6-Deoxyerythronolide B","C21H38O6","C03240","6110"
"4,5-Dihydroxyphthalate","C8H6O6","C03233","6104"
"4-Hydroxypheoxyacetate","C8H8O4","C03235","6105"
"5-Hydroxy-pentanoyl-CoA","C26H44N7O18P3S","C03237","6107"
"5alpha-Cholestan-3-one","C27H46O","C03238","6108"
"3-Oxo-hydroxysteroid","C21H30O4","C02942","5861"
"3-Indoleglycolaldehyde","C10H9NO2","C03230","6101"
"3-Methylglutaconyl-CoA","C27H42N7O19P3S","C03231","6102"
"3-Phosphonooxypyruvate","C3H5O7P","C03232","6103"
"Isoetin","C15H10O7","C10079","12265"
"Mangostin","C24H26O6","C10080","12266"
"1-Isomangostin","C24H26O6","C10071","12257"
"6-Hydroxyluteolin","C15H10O7","C10072","12258"
"Hyperin","C21H20O12","C10073","12259"
"Jacareubin","C18H14O6","C10074","12260"
"Lancerin","C19H18O10","C10075","12261"
"Macluraxanthone","C23H22O6","C10076","12262"
"Mangiferin","C19H18O11","C10077","12263"
"Hypolaetin","C15H10O7","C10078","12264"
"alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine","C20H35NO16","C04847","7404"
"UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine","C40H65N9O26P2","C04846","7403"
"3-Hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oate","C19H24O6","C04844","7401"
"(5Z,9E,14Z)-(8xi,11xi,12S)-8,11,12-Trihydroxyicosa-5,9,14-trienoate","C20H34O5","C04843","7400"
"20-OH-Leukotriene B4","C20H32O5","C04853","7409"
"7-O-Methylluteone","C21H20O6","C07290","9499"
"(5Z,9E,14Z)-(8xi,11R,12S)-11,12-Epoxy-8-hydroxyicosa-5,9,14-trienoicacid","C20H32O4","C04849","7406"
"Variant-surface-glycoprotein 1,2-didecanoyl-sn-phosphatidylinositol","C29H55O13P","C04848","7405"
"7-O-(beta-D-Apiofuranosyl-1,2-beta-D-glucosyl)-5,7,4'-trihydroxyflavone","C26H28O14","C04858","7413"
"(6S)-6-beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adeninedinucleotide","C21H32N7O15P2+","C04856","7411"
"2-Hydroxychromene-2-carboxylate","C10H8O4","C06204","8454"
"Chelidonine","C20H19NO5","C12242","14387"
"Benzoyl phosphate","C7H7O5P","C06206","8456"
"Moxifloxacin hydrochloride","C21H25ClFN3O4","C08054","10254"
"Mirtazapine","C17H19N3","C07570","9773"
"Prontosil","C12H13N5O2S","C07573","9776"
"Citalopram","C20H21FN2O","C07572","9775"
"Rifapentine","C47H64N4O12","C08059","10259"
"Pimozide","C28H29F2N3O","C07566","9769"
"Propylthiouracil","C7H10N2OS","C07569","9772"
"Aminosalicylate sodium anhydrous","C7H6NNaO3","C08055","10255"
"1,2-Dihydronaphthalene-1,2-diol","C10H10O2","C06205","8455"
"2'-Aminobiphenyl-2,3-diol","C12H11NO2","C08061","10261"
"Carbazole","C12H9N","C08060","10260"
"Phencyclidine","C17H25N","C07575","9778"
"Tartrazine","C16H9N4Na3O9S2","C07574","9777"
"Chlormadinone acetate","C23H29ClO4","C12729","583118"
"Cinnarizine","C26H28N2","C12725","583114"
"Metenolone enanthate","C27H42O3","C12731","583120"
"Clinofibrate","C28H36O6","C12730","583119"
"Medazepam","C16H15ClN2","C12722","583111"
"Nicomol","C34H32N4O9","C12721","583110"
"Ethynodiol diacetate","C24H32O4","C12724","583113"
"Ethyl loflazepate","C18H14ClFN2O3","C12723","583112"
"Nonanoic acid","C9H18O2","C01601","4755"
"Troxipide","C15H22N2O4","C12736","583125"
"Feprazone","C20H20N2O2","C12735","583124"
"Nerolidyl diphosphate","C15H28O7P2","C06111","8373"
"gamma-Glutamyl-beta-aminopropiononitrile","C8H13N3O3","C06114","8376"
"L-Arabinofuranose","C5H10O5","C06115","8377"
"4-(4-Deoxy-alpha-D-gluc-4-enuronosyl)-D-galacturonate","C12H16O12","C06118","8378"
"6-Hydroxyhexanoic acid","C6H12O3","C06103","8367"
"Adipate","C6H10O4","C06104","8368"
"Cyclohexan-1,2-dione","C6H8O2","C06105","8369"
"Fluoroacetate","C2H3FO2","C06108","8370"
"Pyridoxalphosphate-6-azophenyl-2',4'-disulfonic acid","C14H14N3O12PS2","C13745","586334"
"3-Ketosphingosine","C18H35NO2","C06121","8379"
"Hexadecenal","C16H30O","C06123","8380"
"Reactive blue 2","C29H20ClN7O11S3","C13746","586335"
"Oxycodone","C18H21NO4","C08018","10218"
"Levorphanol","C17H23NO","C08014","10214"
"Calcium L-aspartate","C4H5CaNO4","C13058","585122"
"Adenosine 5-O-(3-thiodiphophate)","C10H15N5O9P2S","C13743","586332"
"Olaxoside","C48H76O18","C08962","11154"
"Furazolidone","C8H7N3O5","C07999","10200"
"Eflornithine","C6H12F2N2O2","C07997","10198"
"Nifurtimox","C10H13N3O5S","C08002","10203"
"Melarsoprol","C12H15AsN6OS2","C08001","10202"
"Buprenorphine","C29H41NO4","C08007","10207"
"Alfentanil","C21H32N6O3","C08005","10205"
"Levomethadyl acetate","C23H31NO2","C08012","10212"
"Dezocine","C16H23NO","C08010","10210"
"Eupacunin","C22H28O7","C09427","11618"
"2,6-Dihydroxyphenylacetate","C8H8O4","C06207","8457"
"Phenyliodoundecynoate","C17H21IO2","C13054","585119"
"Eupaformosanin","C22H28O8","C09432","11623"
"Bendazac","C16H14N2O3","C13053","585118"
"Eupahyssopin","C20H26O7","C09433","11624"
"Fagaridine","C20H16NO4+","C09430","11621"
"2-Methylaminoadenosine","C11H16N6O4","C03218","6091"
"Eupaformonin","C17H22O5","C09431","11622"
"L-Carnitine","C7H16NO3+","C00318","3612"
"Sphingosine","C18H37NO2","C00319","3613"
"Spermidine","C7H19N3","C00315","3609"
"Amylopectin","C30H52O26","C00317","3611"
"Ferricyanide","C6FeN6-3","C00324","3618"
"GDP-L-fucose","C16H25N5O15P2","C00325","3619"
"2-Oxoadipate","C6H8O5","C00322","3616"
"Caffeoyl-CoA","C30H42N7O19P3S","C00323","3617"
"Glycoprotein","C28H47N5O18","C00326","3620"
"L-Citrulline","C6H13N3O3","C00327","3621"
"11-Hydroxyvittatine","C16H17NO4","C12194","14340"
"Zephyramine","C17H21NO3","C12195","14341"
"ent-6alpha-Hydroxybuphanisine","C17H19NO4","C12192","14338"
"Vittatine","C16H17NO3","C12193","14339"
"9-O-Demethylhomolycorine","C17H19NO4","C12190","14336"
"ent-6beta-Hydroxybuphanisine","C17H19NO4","C12191","14337"
"Vasconine","C17H16NO2+","C12188","14334"
"Ungeremine","C16H12NO3+","C12189","14335"
"Pancracine","C16H17NO4","C12186","14332"
"Pseudolycorine","C16H19NO4","C12187","14333"
"Sinensetin","C20H20O7","C10186","12372"
"Crenatine A","C34H40N4O4","C10002","12188"
"Tamarixetin","C16H12O7","C10188","12374"
"Cys-Gly","C5H10N2O3S","C01419","4606"
"Cystine","C6H12N2O4S2","C01420","4607"
"Daphnin","C15H16O9","C01421","4608"
"Gallate","C7H6O5","C01424","4609"
"Glu-Glu","C10H16N2O7","C01425","4610"
"Lactate","C3H6O3","C01432","4615"
"D-Lysine","C6H14N2O2","C00739","4002"
"Methane","CH4","C01438","4618"
"Neamine","C12H26N4O6","C01441","4619"
"Ouabain","C29H44O12","C01443","4621"
"Ubenimex","C16H24N2O4","C00732","3996"
"Cortisol","C21H30O5","C00735","3998"
"Orcinol","C7H8O2","C00727","3992"
"Tropine","C8H15NO","C00729","3994"
"Betaine","C5H11NO2","C00719","3985"
"Lipoate","C8H14O2S2","C00725","3990"
"a-Tetrasaccharide","C26H45N020","","8988"
"7a,12a-Dihydroxy-3-oxo-4-cholenoic acid","C24H36O5","",""
"5a-Tetrahydrocorticosterone","C21H34O4","","409932"
"4-Hydroxycyclohexylacetic acid","C8H14O3","",""
"2-Furoylglycine","C7H7NO4","","298968"
"Scutellarein","C15H10O6","C10184","12370"
"1-Oleoyl-lysophosphatidic acid","C21H41O7P","","666331"
"3-Furoic acid","C5H4O3","","311971"
"Lasiodine A","C39H49N5O7","C10008","12194"
"Hexanolactone","C6H10O2","","252519"
"4-Decenoic acid","C10H18O2","","3736555"
"Bergapten","C12H8O4","C01557","4715"
"beta-D-Hamamelopyranose","C6H12O6","C08351","10548"
"Calcidiol","C27H44O2","C01561","4719"
"beta-D-Glucosamine","C6H13NO5","C08349","10546"
"Amastatin","C21H38N4O8","C01552","4710"
"beta-D-Sedoheptulopyranose","C7H14O7","C08355","10552"
"Androstane","C19H32","C01554","4712"
"Amsacrine","C21H19N3O3S","C01553","4711"
"alpha-L-Sorbopyranose","C6H12O6","C08356","10553"
"Estradiol-17beta 3-sulfate","C18H24O5S","C08357","10554"
"Carbamate","CH3NO2","C01563","4721"
"Calycosin","C16H12O5","C01562","4720"
"alpha-Cyclopiazonate","C20H20N2O3","C03032","5937"
"O-Carbamoyl-L-serine","C4H8N2O4","C03015","5921"
"O-Propanoylcarnitine","C10H19NO4","C03017","5923"
"6-Methoxy-alpha-pyrufuran","C16H16O6","C08761","10954"
"Phorbol 13-butanoate","C24H34O7","C03019","5925"
"Putaminoxin","C12H20O3","C08509","10702"
"Testosterone acetate","C21H30O3","C03027","5932"
"Eurycomalactone","C19H24O6","C08759","10952"
"Glaucarubin","C25H36O10","C08760","10953"
"Genipin","C11H14O5","C09780","11968"
"Chaparrinone","C20H26O7","C08757","10950"
"Chaparrolide","C20H30O6","C08758","10951"
"Loganin","C17H26O10","C01433","4616"
"D-Serine","C3H7NO3","C00740","4003"
"Cysteine","C3H7NO2S","C00736","3999"
"D-Hexose","C6H12O6","C00738","4001"
"Lophocerine","C15H23NO2","C09571","11762"
"L-Gulono-1,5-lactone","C6H10O6","C05162","7578"
"Lophophorine","C13H17NO3","C09573","11764"
"2-Amino-5-oxocyclohex-1-enecarbonyl-CoA","C28H43N8O18P3S","C05165","7580"
"12-O-Tetradecanoylphorbol 13-acetate","C36H56O8","C05151","7569"
"7-Hydroxy-(S)-usnate","C18H16O7","C05153","7571"
"5-Amino-4-chloro-2-(2-hydroxymuconoyl)-3(2H)-pyridazinone","C10H8ClN3O5","C05155","7572"
"trans-beta-D-Glucosyl-2-hydroxycinnamate","C15H18O8","C05158","7575"
"(-)-Menthyl acetate","C12H22O2","C09870","12056"
"Lucidine B","C30H49N3O","C09869","12055"
"(S)-Cheilanthifoline","C19H19NO4","C05174","7585"
"6,7,12b,13e-Tetrahydro-4H-bis[1,3]benzodioxolo[5,6-a:4',5'-g]quinolizine","C19H17NO4","C05175","7586"
"2(S)-Hydroxyadipic acid","C6H10O5","",""
"Elemicin","C12H16O3","C10451","12634"
"Estragole","C10H12O","C10452","12635"
"Dillapiole","C12H14O4","C10449","12632"
"Echinacoside","C35H46O20","C10450","12633"
"Dihydrocaffeic acid","C9H10O4","C10447","12630"
"Dihydroconiferyl alcohol","C10H14O3","C10448","12631"
"1,3-Dicaffeoylquinic acid","C25H24O12","C10445","12628"
"Diferulic acid","C20H18O8","C10446","12629"
"5,10-Methenyltetrahydromethanopterin","C31H44N6O16P+","C04330","6982"
"Eugenol","C10H12O2","C10453","12636"
"Eugenol methyl ether","C11H14O2","C10454","12637"
"Luteolin 7-O-glucuronide","C21H18O12","C03515","6324"
"Magnesium protoporphyrin","C34H32MgN4O4","C03516","6325"
"L-2-Amino-3-oxobutanoic acid","C4H7NO3","C03508","6318"
"L-Arabinitol 5-phosphate","C5H13O8P","C03509","6319"
"L-Methionine sulfoximine","C5H12N2O3S","C03510","6320"
"Limonoate D-ring-lactone","C26H30O8","C03514","6323"
"Flavonol 3-O-D-galactoside","C21H22O11","C03502","6314"
"Glucosyloxyanthraquinone","C20H18O8","C03503","6315"
"Hydroxyacetone phosphate","C3H7O5P","C03505","6316"
"Indoleglycerol phosphate","C11H14NO6P","C03506","6317"
"2-Hydroxypyridine","C5H5NO","C02502","5514"
"delta-Carotene","C40H56","C08586","10779"
"Apramycin","C21H41N5O11","C01555","4713"
"Yamogenin 3-O-neohesperidoside","C39H62O12","C08919","11111"
"Melatonin","C13H16N2O2","C01598","4752"
"Galacturonic acid","C6H10O7","C08348","10545"
"Bile salt","C24H40O5","C01558","4716"
"alpha-D-Ribulose","C5H10O5","C08354","10551"
"Sulfisoxazole","C11H13N3O3S","C07318","9526"
"Allantoin","C4H6N4O3","C01551","4709"
"2-Phenylacetamide","C8H9NO","C02505","5517"
"beta-D-Ribopyranose","C5H10O5","C08353","10550"
"Benzylformate","C8H8O2","C05613","7933"
"Sinapoyl aldehyde","C11H12O4","C05610","7932"
"S-Adenosyl-L-homocysteine","C14H20N6O5S","C00021","3323"
"2-Hydroxyhepta-2,4-dienedioate","C7H8O5","C05600","7923"
"Phenylacetylglycine","C10H11NO3","C05598","7922"
"4-Hydroxyphenylacetaldoxime","C8H9NO2","C05602","7925"
"4-Hydroxy-2-oxo-heptanedioate","C7H10O6","C05601","7924"
"2-Carboxy-2,3-dihydro-5,6-dihydroxyindole","C9H9NO4","C05604","7927"
"2-Hydroxy-3-(4-hydroxyphenyl)propanoate","C9H8O4","C05603","7926"
"4-Hydroxycinnamyl aldehyde","C9H8O2","C05608","7931"
"Phenyllactate","C9H10O3","C05607","7930"
"8-(1,1-Dimethylallyl)galangin","C20H18O5","C11581","13746"
"8-(1,1-DMA)kaempferide","C21H20O6","C11580","13745"
"Prilocaine","C13H20N2O","C07531","9734"
"Ropivacaine","C17H26N2O","C07532","9735"
"Ketamine","C13H16ClNO","C07525","9728"
"2-p-Tolyl-5,6,7,8-tetrahydrobenzo[d]imidazo[2,1-b]thiazole","C16H16N2S","C11571","13736"
"Propofol","C12H18O","C07523","9726"
"6-Geranylchrysin","C25H26O4","C11574","13739"
"3-Methylgalangin","C16H12O5","C11577","13742"
"6-(3,3-DMA)galangin","C20H18O5","C11576","13741"
"Benzocaine","C9H11NO2","C07527","9730"
"8-(3,3-Dimethylallyl)-3-methylgalangin","C21H20O5","C11578","13743"
"4-Carboxymethyl-4-methylbut-2-en-1,4-olide","C7H8O4","C04559","7163"
"Benzyl (2R,3S)-2-methyl-3-hydroxybutanoate","C12H16O3","C04561","7164"
"Pyruvate","C3H4O3","C00022","3324"
"1-(4-Hydroxyphenyl)-2-(methylamino)ethanol","C9H13NO2","C04548","7154"
"2-Hydroxy-4-oxobutane-1,2,4-tricarboxylate","C7H8O8","C04551","7156"
"3',4',5-Trihydroxy-3,6,7-trimethoxyflavone","C18H16O8","C04552","7157"
"3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate","C7H6O6","C04553","7158"
"3alpha,7alpha-Dihydroxy-5beta-cholestanate","C27H46O4","C04554","7159"
"3beta-Hydroxyandrost-5-en-17-one 3-sulfate","C19H28O5S","C04555","7160"
"4-Amino-2-methyl-5-phosphomethylpyrimidine","C6H10N3O4P","C04556","7161"
"4-Carboxymethyl-3-methylbut-2-en-1,4-olide","C7H8O4","C04558","7162"
"beta-Cryptoxanthin","C40H56O","C08591","10784"
"Ribitol 5-phosphate","C5H13O8P","C02883","5814"
"Phyllanthin","C24H34O6","C10746","12929"
"Norfloxacin","C16H18FN3O3","C06687","8912"
"Maculine","C13H9NO4","C10714","12897"
"Dihydroneopterin phosphate","C9H14N5O7P","C05925","8213"
"Molybdopterin","C10H14N5O6PS2","C05924","8212"
"Neoisostegane","C23H26O7","C10707","12890"
"Mallotophenone","C21H24O8","C10708","12891"
"4-Sulfobenzaldehyde","C7H6O4S","C06679","8904"
"Lupulone","C26H38O4","C10706","12889"
"(3Z)-Phycoerythrobilin","C33H38N4O6","C05912","8200"
"Pentahydroxyflavanone","C15H12O7","C05911","8199"
"Ceftriaxone","C18H18N8O7S3","C06683","8908"
"DL-Cycloserine","C3H6N2O2","C06682","8907"
"alpha-Methyl-m-tyramine","C9H13NO","C11776","13940"
"Xamoterol","C16H25N3O5","C11775","13939"
"Methazolamide","C5H8N4O3S2","C07764","9966"
"Methyclothiazide","C9H11Cl2N3O4S2","C07765","9967"
"Cephalothin","C16H16N2O6S2","C07761","9963"
"Hydroflumethiazide","C8H8F3N3O4S2","C07763","9965"
"Benzthiazide","C15H14ClN3O4S3","C07759","9961"
"Epanolol","C20H23N3O4","C11773","13937"
"7-Aminocephalosporanic acid","C10H12N2O5S","C07756","9958"
"Xanomeline","C14H23N3OS","C11767","13931"
"R-Salbutamol","C13H21NO3","C11770","13934"
"R-Soterenol","C12H20N2O4S","C11769","13933"
"Trichloroacetate","C2HCl3O2","C11150","13332"
"Phenylmercury acetate","C8H9HgO2","C11151","13333"
"Pterosterone","C27H44O7","C08838","11031"
"Proacacipetalin","C11H17NO6","C08338","10536"
"Sulfonylbismethane","C2H6O2S","C11142","13324"
"Dimethyl sulfoxide","C2H6OS","C11143","13325"
"Methoxymethane","C2H6O","C11144","13326"
"Methanesulfonic acid","CH4O3S","C11145","13327"
"Methylmercury chloride","CH3ClHg","C11146","13328"
"Fluoromethane","CH3F","C11147","13329"
"TCE epoxide","C2HCl3O","C11148","13330"
"Dichloroacetate","C2HCl2O2-","C11149","13331"
"2-O-Acetylpseudolycorine","C18H21NO5","C12237","14382"
"Roxithromycin","C41H76N2O15","C13173","585237"
"Iotrolan","C37H48I6N6O18","C13177","585241"
"Cilomilast","C20H25NO4","C13165","585229"
"Fluticasone propionate","C25H31F3O5S","C13171","585235"
"Dalcotidine","C18H29N3O2","C13159","585223"
"Ciclesonide","C32H44O7","C13164","585228"
"Dehydrocholic acid","C24H34O5","C13154","585218"
"Panthenyl ethyl ether","C11H23NO4","C13155","585219"
"Vesnarinone","C22H25N3O4","C13151","585215"
"Nipradilol","C15H22N2O6","C13152","585216"
"Mercaptoacetyl-Phe-Leu","C17H24N2O4S","C03292","6149"
"N-Phospholombricine","C6H16N4O9P2","C14178","7846990"
"Lombricine","C6H15N4O6P","C14177","7846989"
"Chlordane","C10H6Cl8","C14176","7846988"
"Diethyl phthalate","C12H14O4","C14175","7846987"
"Allocain-S","C20H25NO2","C14174","7846986"
"Piperocaine","C16H23NO2","C14173","7846985"
"Hexylcaine","C16H23NO2","C14172","7846984"
"Orthoform","C8H9NO3","C14171","7846983"
"p-Aminosalicylic acid methyl ester","C8H9NO3","C14170","7846982"
"Stovaine","C14H21NO2","C14169","7846981"
"gamma-Nonalactone","C9H16O2","C08501","10694"
"Lysopine","C9H18N2O4","C08500","10693"
"Nona-2,6-dienal","C9H14O","C08499","10692"
"Lilac aldehyde","C10H16O2","C08498","10691"
"Leaf aldehyde","C6H10O","C08497","10690"
"Lycomarasmine B","C9H15N3O7","C08496","10689"
"Karakin","C15H21N3O15","C08495","10688"
"Isotan B","C14H15NO7","C08494","10687"
"Pinolidoxin","C18H26O6","C08503","10696"
"Parasorbic acid","C6H8O2","C08502","10695"
"Carbidopa-levodopa","C19H25N3O8","C06870","9087"
"FAD","C27H33N9O15P2","C00016","3318"
"UDP","C9H14N2O12P2","C00015","3317"
"Dopaquinone","C9H9NO4","C00822","4080"
"D-Threonine","C4H9NO3","C00820","4078"
"D-Glutamine","C5H10N2O3","C00819","4077"
"D-Glucarate","C6H10O8","C00818","4076"
"D-Altronate","C6H12O7","C00817","4075"
"Citramalate","C5H8O5","C00815","4073"
"Biochanin A","C16H12O5","C00814","4072"
"Barbiturate","C4H4N2O3","C00813","4071"
"4-Coumarate","C9H8O3","C00811","4069"
"(R)-Acetoin","C4H8O2","C00810","4068"
"Sarmentosin epoxide","C11H17NO8","C08341","10539"
"Dichloromethane","CH2Cl2","C02271","5331"
"19-Hydroxytestosterone","C19H28O3","C05294","7678"
"5beta-Dihydrotestosterone","C19H30O2","C05293","7677"
"19-Oxoandrost-4-ene-3,17-dione","C19H24O3","C05297","7681"
"7alpha-Hydroxyandrost-4-ene-3,17-dione","C19H26O3","C05296","7680"
"Adrenosterone","C19H24O3","C05285","7672"
"11beta-Hydroxyandrost-4-ene-3,17-dione","C19H26O3","C05284","7671"
"7alpha-Hydroxytestosterone","C19H28O3","C05291","7676"
"19-Hydroxyandrost-4-ene-3,17-dione","C19H26O3","C05290","7675"
"2-Methoxyestrone","C19H24O3","C05299","7683"
"2-Hydroxyestrone","C18H22O3","C05298","7682"
"N4-(Acetyl-beta-D-glucosaminyl)asparagine","C12H21N3O8","C04540","7146"
"(Z)-2-Decene-4,6,8-triynoic acid methylester","C11H8O2","C08774","10967"
"Nomilin","C28H34O9","C08773","10966"
"Harrisonin","C27H32O10","C08766","10959"
"Glycinoeclepin A","C25H36O6","C08765","10958"
"Ichangin","C26H32O9","C08768","10961"
"12alpha-Hydroxyamoorstatin","C28H36O10","C08767","10960"
"Isobrucein B","C23H28O11","C08770","10963"
"Isobrucein A","C26H34O11","C08769","10962"
"Nigakihemiacetal A","C22H34O7","C08772","10965"
"Neoquassin","C22H30O6","C08771","10964"
"Multigilin","C20H24O6","C09514","11705"
"Multiradiatin","C20H22O6","C09515","11706"
"D-Xylonolactone","C5H8O5","C02266","5327"
"Microhelenin A","C15H18O4","C09508","11699"
"Microhelenin C","C20H26O5","C09509","11700"
"Michelenolide","C15H20O4","C09506","11697"
"Micheliolide","C15H20O3","C09507","11698"
"Molephantin","C19H22O6","C09512","11703"
"Molephantinin","C20H24O6","C09513","11704"
"Microlenin","C29H34O7","C09510","11701"
"Mikanolide","C15H14O6","C09511","11702"
"D-galacto-Hexodialdose","C6H10O6","C03269","6132"
"5-Oxopentanoate","C5H8O3","C03273","6134"
"D-Fructose 2-phosphate","C6H13O9P","C03267","6130"
"2-Iodophenol","C6H5IO","C01874","4988"
"PM-Toxin A","C33H60O8","C08553","10746"
"Lampranthin II","C34H34N2O16","C08552","10745"
"Glycerophosphoglycerol","C6H15O8P","C03274","6135"
"Imidazol-5-yl-pyruvate","C6H6N2O3","C03277","6136"
"1-Sinapoyl-D-glucose","C17H22O10","C02919","5842"
"Humilixanthin","C14H18N2O7","C08548","10741"
"Isobetanin","C24H26N2O13","C08551","10744"
"L-Glutamyl 5-phosphate","C5H10NO7P","C03287","6144"
"(S)-N-Methylcanadine","C21H24NO4+","C02915","5838"
"Gomphrenin-I","C24H26N2O13","C08544","10737"
"Pteryxin","C21H22O7","C09307","11498"
"Tiglyl tiglate","C10H16O2","C08546","10739"
"13-beta-D-Glucosyloxydocosanoate","C28H54O8","C04103","6794"
"1-Palmitoylglycerophosphocholine","C24H51NO7P+","C04102","6793"
"1-O,6-O-Digalloyl-beta-D-glucose","C20H20O14","C04101","6792"
"1-Linoleoylglycerophosphocholine","C26H51NO7P+","C04100","6791"
"20-Hydroxy-3-oxopregn-4-en-21-al","C21H30O3","C04108","6798"
"2-(Hydroxymethyl)-4-oxobutanoate","C5H8O4","C04106","6797"
"2,5-Dihydro-5-oxofuran-2-acetate","C6H6O4","C04105","6796"
"Coleone A","C20H22O6","C10317","12503"
"Kaempferide","C16H12O6","C10098","12284"
"Kuwanone G","C40H36O11","C10099","12285"
"3,5-Dihydroxy-1,4-naphthoquinone","C10H6O4","C04110","6800"
"3,3',4',5,7,8-Hexahydroxyflavone","C15H10O8","C04109","6799"
"Swertianolin","C20H20O11","C10093","12279"
"1,3,5-Trihydroxyxanthone","C13H8O5","C10094","12280"
"Swerchirin","C15H12O6","C10091","12277"
"Swertianin","C14H10O6","C10092","12278"
"Butyl acrylate","C7H12O2","C10921","13104"
"Glycidol","C3H6O2","C10920","13103"
"2-Nitrofluorene","C13H9NO2","C10923","13106"
"2,3-Dimercaptopropane-1-sulfonic acid","C3H8O3S3","C10922","13105"
"7-N,N-Dimethylamino-1,2,3,4,5-pentathiocyclooctane","C5H11NS5","C10917","13100"
"2-Dimethylamino-5,6-dimethylpyrimidin-4-ol","C8H13N3O","C10916","13099"
"Mepanipyrim","C14H13N3","C10919","13102"
"Indeloxazine","C14H17NO2","C10918","13101"
"Acetochlor","C14H20ClNO2","C10925","13108"
"9-Hydroxy-2-nitrofluorene","C13H9NO3","C10924","13107"
"2-Hydroxymuconate","C6H6O5","C02501","5513"
"Desogestrel","C22H30O","C07629","9831"
"Methallenestril","C18H22O3","C07621","9823"
"Luteolin 7-O-(6''-malonylglucoside)","C24H22O14","C10103","12289"
"Quinupristin","C53H67N9O10S","C08032","10232"
"Erythromycin estolate","C52H97NO18S","C08031","10231"
"Remifentanil","C20H28N2O5","C08021","10221"
"Oxymorphone","C17H19NO4","C08019","10219"
"Hydrocodone","C18H21NO3","C08024","10224"
"Sufentanil","C22H30N2O2S","C08022","10222"
"Nalmefene","C21H25NO3","C08027","10227"
"Oxycodone hydrochloride","C18H22ClNO4","C08026","10226"
"Minocycline hydrochloride","C23H28ClN3O7","C08030","10230"
"Methacycline hydrochloride","C22H23ClN2O8","C08029","10229"
"Macarpine","C22H18NO6+","C06165","8420"
"1,2-Dehydroreticuline","C19H22NO4+","C06167","8421"
"Morin","C15H10O7","C10105","12291"
"D-Fucono-1,4-lactone","C6H10O5","C06158","8414"
"2-Dehydro-3-deoxy-D-fuconate","C6H10O5","C06159","8415"
"D-Glucosamine 1-phosphate","C6H14NO8P","C06156","8412"
"S-Glutaryldihydrolipoamide","C13H23NO4S2","C06157","8413"
"Sanguinarine","C20H14NO4+","C06162","8418"
"(S)-cis-N-methylstylopine","C20H20NO4+","C06163","8419"
"(S)-Norcoclaurine","C16H17NO3","C06160","8416"
"(S)-Coclaurine","C17H19NO3","C06161","8417"
"(-)-Usnic acid","C18H16O7","C10101","12287"
"6-Methoxyluteolin 7-rhamnoside","C22H22O11","C10104","12290"
"(-)-Comphene","C10H16","C06305","8541"
"p-Cymene","C10H14","C06575","8804"
"p-Cumic alcohol","C10H14O","C06576","8805"
"p-Cumic aldehyde","C10H12O","C06577","8806"
"1-Epideacetylbowdensine","C17H21NO5","C12169","14316"
"Zephyranthine","C16H19NO4","C12170","14317"
"1,2-O-Diacetylzephyranthine","C20H23NO6","C12171","14318"
"p-Cumate","C10H12O2","C06578","8807"
"3-O-Acetylhamayne","C18H19NO5","C12165","14312"
"1-O-Acetyllycorine","C18H19NO5","C12166","14313"
"Cherylline","C17H19NO3","C12167","14314"
"Crinamidine","C17H19NO5","C12168","14315"
"Chlortetracycline","C22H23ClN2O8","C06571","8800"
"Norgalanthamine","C16H19NO3","C12173","14320"
"Haemanthidine","C17H19NO5","C12174","14321"
"Nystatin","C47H75NO17","C06572","8801"
"Lyconnotine","C17H25NO3","C09881","12067"
"Amphotericin B","C47H73NO17","C06573","8802"
"Ampicillin","C16H19N3O4S","C06574","8803"
"Hexylamine","C6H15N","C08306","10504"
"Glyburide","C23H28ClN3O5S","C07022","9234"
"Fosinopril","C30H46NO7P","C07016","9228"
"Flecainide","C17H20F6N2O3","C07001","9214"
"Fexofenadine","C32H39NO4","C06999","9212"
"Fenoprofen","C15H14O3","C06997","9210"
"Fenfluramine","C12H16F3N","C06996","9209"
"Fluvastatin","C24H26FNO4","C07014","9227"
"Fluphenazine","C22H26F3N3OS","C07010","9223"
"Fluocinolone","C21H26F2O6","C07006","9219"
"Fludrocortisone","C21H29FO5","C07004","9217"
"2,5-Diaminohexanoate","C6H14N2O2","C05161","7577"
"Tutin","C15H18O6","C09570","11761"
"2-Chloro-4-hydroxy-6-amino-1,3,5-triazine","C3H3ClN4O","C08735","10928"
"Fawcettidine","C16H23NO","C09862","12048"
"19-Hydroxytabersonine","C21H24N2O3","C11642","13807"
"Ursiniolide A","C22H28O7","C09572","11763"
"Bufotenine","C12H16N2O","C08299","10497"
"Menthofuran","C10H14O","C09868","12054"
"Patrinoside","C21H34O11","C11640","13805"
"Inundatine","C16H23NO2","C09867","12053"
"Acacetin","C16H12O5","C01470","4645"
"Acrolein","C3H4O","C01471","4646"
"4-Cresol","C7H8O","C01468","4643"
"ADPsugar","C22H35N5O20P2","C01469","4644"
"Xanthan","C13H10O","C01464","4641"
"3-Cresol","C7H8O","C01467","4642"
"Tyr-OEt","C11H15NO3","C01458","4635"
"Vitexin","C21H20O10","C01460","4637"
"4-hydroxybenzyl alcohol","C7H8O2","","155483"
"Deoxyloganin tetraacetate","C25H34O13","C11646","13811"
"4H-1-Benzopyran-4-one, 3-((6-deoxy-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-","C21H20O10","","215559"
"3-Hydroxydodecanedioic acid","C12H22O5","",""
"5,10-methylene-THMPT","C31H45N6O15P","",""
"isopentenyladenine-7-N-glucoside","C16H23N5O5","",""
"Alizarin","C14H8O4","C01474","4647"
"Allysine","C6H11NO3","C01475","4648"
"2-(2-Aminoethyl)indole","C10H12N2","C02548","5552"
"2-Caffeoylisocitrate","C15H14O10","C02927","5849"
"Lamiide","C17H26O12","C11644","13809"
"2'-Hydroxychalcone","C15H12O2","C09321","11512"
"D-O-Phosphoserine","C3H8NO6P","C02532","5539"
"Chenodeoxycholate","C24H40O4","C02528","5536"
"Dimethyl selenide","C2H6Se","C02535","5542"
"Lamioside","C18H28O11","C11645","13810"
"Estrone 3-sulfate","C18H22O5S","C02538","5545"
"Actinodaphnine","C18H17NO4","C09322","11513"
"Formyl-methionine","C6H11NO3S","C02542","5547"
"Fenprofen calcium","C30H26CaO6","C02539","5546"
"Bacterio-chlorophyll b","C55H72MgN4O6","C11243","13421"
"Adiantifoline","C42H50N2O9","C09323","11514"
"Bacterio-chlorophyll a","C55H74MgN4O6","C11242","13420"
"Visnadin","C21H24O7","C09316","11507"
"Rufloxacin","C17H18FN3O3S","C11240","13419"
"Bougainvillein-r-I","C30H36N2O18","C08541","10734"
"MK 571","C26H27ClN2O3S2","C11239","13418"
"2-Methyleneglutarate","C6H8O4","C02930","5852"
"(R,S)-Norcoclaurine","C16H17NO3","C06346","8582"
"Abyssinone V","C25H28O5","C09319","11510"
"DU-6859","C19H18ClF2N3O3","C11248","13425"
"Hopane-29-acetate","C32H54O2","C08627","10820"
"(R,S)-Coclaurine","C17H19NO3","C06348","8584"
"(R)-Coclaurine","C17H19NO3","C06349","8585"
"4-(Trimethylammonio)but-2-enoate","C7H14NO2+","C04114","6803"
"4-Carboxy-4-hydroxy-2-oxoadipate","C7H8O8","C04115","6804"
"3beta-Hydroxysterol","C28H42O","C02799","5749"
"3-Phosphonopyruvate","C3H5O6P","C02798","5748"
"3-Oxo-5beta-steroid","C19H30O","C02797","5747"
"3-Methyleneoxindole","C9H7NO","C02796","5746"
"3-Hydroxykynurenine","C10H12N2O4","C02794","5745"
"2-Hydroxy-vitamin K","C31H48O3","C02793","5744"
"3-Fluorobenzoyl-CoA","C28H39FN7O17P3S","C02792","5743"
"3,4-Dichloroaniline","C6H5Cl2N","C02791","5742"
"3'-Hydroxyflavonoid","C15H10O3","C02790","5741"
"2-trans-Hexadecenal","C16H30O","C02788","5739"
"L-1-Aminopropan-2-ol O-phosphate","C3H10NO4P","C04126","6812"
"Methyl 2-diazoacetamidohexanoate","C9H16N3O3+","C04130","6816"
"Isocoproporphyrin","C36H38N4O8","","747313"
"Methyl o-methoxyhippuric acid","C11H13NO4","","326697"
"beta-Citronellol","C10H20O","C09849","12036"
"(R)-(+)-Citronellal","C10H18O","C09848","12035"
"Carvone oxide","C10H14O2","C09841","12028"
"Carvacrol","C10H14O","C09840","12027"
"Chrysanthenone","C10H14O","C09843","12030"
"Chrysanthemic acid","C10H16O2","C09842","12029"
"Cinerin I","C20H28O3","C09845","12032"
"1,8-Cineole","C10H18O","C09844","12031"
"cis-Citral","C10H16O","C09847","12034"
"Cinerin II","C21H28O5","C09846","12033"
"Citramalyl-CoA","C26H42N7O20P3S","C00904","4159"
"D-Fructuronate","C6H10O7","C00905","4160"
"Isobutyrylglycine methyl ester","C7H13NO3","",""
"Propenoyl-CoA","C24H38N7O17P3S","C00894","4150"
"Tos-Lys-CH2Cl","C14H21ClN2O3S","C00896","4152"
"alpha-Maltose","C12H22O11","C00897","4153"
"(R,R)-Tartaric acid","C4H6O6","C00898","4154"
"11-cis-Retinol","C20H30O","C00899","4155"
"2-Acetolactate","C5H8O4","C00900","4156"
"2-Oxohexanoic acid","C6H10O3","C00902","4157"
"Cinnamaldehyde","C9H8O","C00903","4158"
"Flabellidine","C18H28N2O","C09865","12051"
"Iresinin I","C36H42N2O23","C08550","10743"
"D-Ribose 1-diphosphate","C5H12O10P2","C06248","8487"
"Squamocin","C37H66O7","C08545","10738"
"Wyerone","C15H14O4","C08465","10658"
"Cyclohexane-1-carboxylate","C7H12O2","C09822","12010"
"N-hydroxyl-tryptamine","C10H12N2O","",""
"Paniculatin","C27H30O15","C10513","12696"
"(-)-Phaseollin","C20H18O4","C10514","12697"
"3-Methoxy-4-hydroxymandelate","C9H10O5","C05584","7910"
"3-Methoxy-4-hydroxyphenylglycolaldehyde","C9H10O4","C05583","7909"
"Homovanillate","C9H10O4","C05582","7908"
"3-Methoxy-4-hydroxyphenylacetaldehyde","C9H10O3","C05581","7907"
"3,4-Dihydroxymandelate","C8H8O5","C05580","7906"
"Indole-5,6-quinone","C8H5NO2","C05579","7905"
"5,6-Dihydroxyindole","C8H7NO2","C05578","7904"
"3,4-Dihydroxymandelaldehyde","C8H8O4","C05577","7903"
"3,4-Dihydroxyphenylethyleneglycol","C8H10O4","C05576","7902"
"Hercynine","C9H16N3O2+","C05575","7901"
"Topiramate","C12H21NO8S","C07502","9705"
"Tiagabine","C20H25NO2S2","C07503","9706"
"Zonisamide","C8H8N2O3S","C07504","9707"
"Ethosuximide","C7H11NO2","C07505","9708"
"Propantheline","C23H30NO3+","C07506","9709"
"Pirenzepine","C19H21N5O2","C07508","9711"
"Diacetylmonoxime","C4H7NO2","C07509","9712"
"Hexamethonium","C12H30N2+2","C07510","9713"
"Mecamylamine","C11H21N","C07511","9714"
"Tetraethylammonium","C8H20N+","C07512","9715"
"Carfentrazone","C13H10Cl2F3N3O3","C11493","13663"
"NOPM","C14H14O3","C11492","13662"
"NOP","C13H12O3","C11491","13661"
"AMCC","C7H12N2O4S","C11490","13660"
"NMF","C2H5NO","C11489","13659"
"HMMF","C3H7NO2","C11488","13658"
"3,3',4',5,7-Pentahydroxy-8-methoxyflavone","C16H12O8","C04527","7138"
"(3S,4S)-3-Hydroxytetradecane-1,3,4-tricarboxylate","C17H30O7","C04529","7139"
"24-Methylene-5alpha-cholest-8-en-3beta-ol","C28H46O","C04525","7136"
"3'-Deoxydihydrostreptomycin 3''-phosphate","C21H40N7O14P","C04526","7137"
"2-Chloro-2,5-dihydro-5-oxofuran-2-acetate","C6H5ClO4","C04522","7134"
"2-Protocatechoylphloroglucinolcarboxylate","C14H10O8","C04524","7135"
"1D-myo-Inositol 3,4,5,6-tetrakisphosphate","C6H16O18P4","C04520","7132"
"2,7-Anhydro-alpha-N-acetylneuraminic acid","C11H17NO8","C04521","7133"
"1,2,3,6-Tetrakis-O-galloyl-beta-D-glucose","C34H28O22","C04516","7129"
"17alpha,20alpha-Dihydroxypregn-4-en-3-one","C21H32O3","C04518","7131"
"Uvaricin","C39H68O7","C08572","10765"
"Nortrachelogenin","C20H22O7","C10725","12908"
"Xanthoxylin","C10H12O4","C10726","12909"
"Melochinone","C22H21NO2","C10727","12910"
"Otobain","C20H20O4","C10728","12911"
"cis-1,2-Dihydroxy-1,2-dihydrodibenzothiophene","C12H10O2S","C06721","8944"
"1,6-Dihydroxy-5-methylcyclohexa-2,4-dienecarboxylate","C8H10O4","C06720","8943"
"6-Carboxyhex-2-enoyl-CoA","C28H44N7O19P3S","C06723","8946"
"O-Methylptelefolonium","C18H22NO4+","C10732","12915"
"5,6-Dihydroxy-3-methyl-2-oxo-1,2,5,6-tetrahydroquinoline","C10H11NO3","C06726","8948"
"5,6-Dihydroxy-3-methyl-2-oxo-1,2-dihydroquinoline","C10H9NO3","C06725","8947"
"(S)-6-O-Methylnorlaudanosoline","C17H19NO4","C06517","8748"
"(R)-Norreticuline","C18H21NO4","C06516","8747"
"Netilmicin","C21H41N5O7","C07657","9859"
"Sulfadiazine","C10H10N4O2S","C07658","9860"
"Sulfathalidine","C17H13N3O5S2","C07659","9861"
"Levofloxacin","C18H20FN3O4","C07660","195031"
"Flutamide","C11H11F3N2O3","C07653","9855"
"Methacycline","C22H22N2O8","C07654","9856"
"Streptobiosamine","C13H23NO9","C07655","9857"
"Gentamicin C1","C21H43N5O7","C07656","9858"
"Gatifloxacin","C19H22FN3O4","C07661","9863"
"Sparfloxacin","C19H22F2N4O3","C07662","9864"
"Napelline","C22H33NO3","C08700","10893"
"Lindheimerine","C22H31NO2","C08695","10888"
"Lappaconitine","C32H44N2O8","C08694","10887"
"Lycoctonine","C25H41NO7","C08697","10890"
"Lycaconitine","C36H48N2O10","C08696","10889"
"3-Iodo-L-tyrosine","C9H10INO3","C02515","5525"
"Oxandrolone","C19H30O3","C07346","9553"
"2-Methyl-5-hydroxytryptamine","C11H14N2O","C13665","586258"
"Tropisetron","C17H20N2O2","C13666","586259"
"2,3-Dioxo-6-nitro-7-sulfamoylbenzo(f)quinoxaline","C12H8N4O6S","C13667","586260"
"6-Cyano-7-nitroquinoxaline-2,3-dione","C9H4N4O4","C13668","586261"
"Talampanel","C19H19N3O3","C13670","586262"
"(S)-F-Willardiine","C7H10FN3O4","C13671","586263"
"(S)-AMPA","C7H10N2O4","C13672","586264"
"(S)-ACPA","C8H10N2O5","C13673","586265"
"1-Naphthylacetylspermine","C22H34N4O","C13674","586266"
"Sodium deoxycholate","C24H39NaO4","C11171","13353"
"Simazine","C7H12ClN5","C11172","13354"
"Sulfathiazole","C9H9N3O2S2","C11169","13351"
"Sulbenicillin","C16H18N2O7S2","C11170","13352"
"SDS","C12H25NaO4S","C11166","13348"
"Tetrabenazine","C19H27NO3","C11168","13350"
"CCCP","C9H5ClN4","C11164","13346"
"Thiolactomycin","C11H14O2S","C11165","13347"
"5'-Methoxyhydnocarpin-D","C26H22O10","C11162","13344"
"INF271","C18H16N2O2","C11163","13345"
"Hexanoyl-CoA","C27H46N7O17P3S","C05270","7657"
"Methaphenilene","C15H20N2S","C11113","13295"
"3-Hydroxyquinine","C20H24N2O3","C07344","9551"
"Ceftiofur sodium","C19H16N5NaO7S3","C13143","585207"
"Cefteram pivoxil","C22H27N9O7S2","C13147","585211"
"Thioinosine","C10H12N4O4S","C13139","585203"
"3-Oxohexanoyl-CoA","C27H44N7O18P3S","C05269","7656"
"Acetomenaphthone","C15H14O4","C13137","585201"
"Cadralazine","C12H21N5O3","C13274","586018"
"Naftopidil","C24H28N2O3","C13135","585199"
"Felbinac","C14H12O2","C13136","585200"
"S-Hydroprene","C17H30O2","C13284","586028"
"Iohexol","C19H26I3N3O9","C13287","586031"
"Epalrestat","C15H13NO3S2","C13149","585213"
"Loteprednol etabonate","C24H31ClO7","C13150","585214"
"alpha-Peltatin","C21H20O8","C10729","12912"
"Betaine aldehyde hydrate","C5H14NO2+","C07345","9552"
"3,3',5,5'-Tetrachloro-4,4'-biphenyldiol","C12H6Cl4O2","C14194","7847004"
"2,5-Dichloro-4'-biphenylol","C12H8Cl2O","C14193","7847003"
"2,3,5,6-Tetrachloro-4,4'-biphenyldiol","C12H6Cl4O2","C14196","7847006"
"4-Chloro-4'-biphenylol","C12H9ClO","C14195","7847005"
"2,3,4,5-Tetrachloro-4'-biphenylol","C12H6Cl4O","C14190","7847000"
"2,4,6-Trichloro-4'-biphenylol","C12H7Cl3O","C14189","7846999"
"2,6-Dichloro-4'-biphenylol","C12H8Cl2O","C14192","7847002"
"2-Chloro-4,4'-biphenyldiol","C12H9ClO2","C14191","7847001"
"2,2'3,4',6,6'-Hexachloro-4-biphenylol","C12H4Cl6O","C14198","7847008"
"2,2',3,3',6,6'-Hexachloro-4-biphenylol","C12H4Cl6O","C14197","7847007"
"4-Methoxybenzoate","C8H8O3","C02519","5529"
"beta-Peltatin A methyl ether","C23H24O8","C10730","12913"
"Quinethazone","C10H12ClN3O3S","C07342","9549"
"(2S)-2-Isopropylmalate","C7H12O5","C02504","5516"
"Pyridoxal phosphate","C8H10NO6P","C00018","3320"
"(R)-Prunasin","C14H17NO6","C00844","4101"
"(-)-Menthone","C10H18O","C00843","4100"
"3-Oxoadipate","C6H8O5","C00846","4103"
"2-Furoyl-CoA","C26H38N7O18P3S","C00845","4102"
"Vasopressin","C92H130N28O24S4","C00840","4097"
"Streptidine","C8H18N6O4","C00837","4095"
"dTDPglucose","C16H26N2O16P2","C00842","4099"
"Xanthotoxol","C11H6O4","C00841","4098"
"4-Bromophenol","C6H5BrO","C14453","150902"
"Morpholine","C4H9NO","C14452","151205"
"N-Ethylaniline","C8H11N","C14455","150752"
"2,4,6-Tribromophenol","C6H3Br3O","C14454","151517"
"6-Oxocineole","C10H16O2","C00848","4105"
"4-Pyridoxate","C8H9NO4","C00847","4104"
"2-Hydroxybenzo(a)pyrene","C20H12O","C14459","182661"
"Dihydrogenistein","C15H12O5","C14458",""
"Rugosinone","C19H15NO6","C09634","11824"
"Oxamniquine","C14H21N3O3","C07341","9548"
"Brusatol","C26H32O11","C08754","10947"
"Bruceoside A","C32H42O16","C08753","10946"
"Bruceine D","C20H26O9","C08752","10945"
"Bruceine B","C23H28O11","C08751","10944"
"Bruceantinol","C30H38O13","C08750","10943"
"Bruceantin","C28H36O11","C08749","10942"
"Azadirachtin A","C35H44O16","C08748","10941"
"Ailanthone","C20H24O7","C08747","10940"
"Ailanthinone","C25H34O9","C08746","10939"
"Lithospermic acid","C27H22O12","C08745","10938"
"Isomontanolide","C22H30O7","C09486","11677"
"Isotenulin","C17H22O5","C09487","11678"
"Ivalin","C15H20O3","C09488","11679"
"Lactucin","C15H16O5","C09489","11680"
"Lactupicrin","C23H22O7","C09490","11681"
"Laserolide","C22H30O6","C09491","11682"
"Laurenobiolide","C17H22O4","C09492","11683"
"Liatrin","C22H26O8","C09493","11684"
"Ligulatin B","C17H22O5","C09494","11685"
"Linderane","C15H16O4","C09495","11686"
"Acetyl-CoA","C23H38N7O17P3S","C00024","3326"
"Gentamicin A","C18H36N4O10","C01917","5024"
"Protochlorophyllide","C35H32MgN4O5","C02880","5811"
"Erythromycin","C37H67NO13","C01912","5020"
"Ferrocyanide","C6FeN6-4","C01913","5021"
"O-Butanoylcarnitine","C11H21NO4","C02862","5799"
"O-Demethylpuromycin","C21H27N7O5","C02864","5801"
"O-Sinapoylglucarate","C17H20O12","C02866","5802"
"Orsellinate depside","C16H14O7","C02868","5804"
"S-Hexyl-glutathione","C16H29N3O6S","C02886","5817"
"Sinapoyl-(S)-malate","C15H16O9","C02887","5818"
"Glycocholate","C26H43NO6","C01921","5027"
"Homoarginine","C7H16N4O2","C01924","5030"
"Dasytrichone","C18H16O4","C10035","12221"
"Datiscetin","C15H10O6","C10036","12222"
"5-Deoxykaempferol","C15H10O5","C10037","12223"
"Diosmetin","C16H12O6","C10038","12224"
"Chrysosplenol C","C18H16O8","C10031","12217"
"Cirsilineol","C18H16O7","C10032","12218"
"Cirsiliol","C17H14O7","C10033","12219"
"Cupressuflavone","C30H18O10","C10034","12220"
"Pristimerin","C30H40O4","C08633","10826"
"Diosmin","C28H32O15","C10039","12225"
"Eupatilin","C18H16O7","C10040","12226"
"2-Methoxyestrone 3-glucuronide","C25H32O9","C11132","13314"
"Pollinastanol","C28H48O","C08833","11026"
"Estrone glucuronide","C24H30O8","C11133","13315"
"Ibuprofen piconol","C19H23NO2","C12520","582910"
"Rebamipide","C19H15ClN2O4","C12519","582909"
"Zinc undecylenate","C22H38O4Zn","C12522","582912"
"Seratrodast","C22H26O4","C12521","582911"
"Bucetin","C12H17NO3","C12513","582903"
"Chlorobenzene","C6H5Cl","C06990","9203"
"Eplerenone","C24H30O6","C12512","582902"
"beta-D-Mannosylphosphodecaprenol","C56H93O9P","C04150","6835"
"alpha-N-Phenylacetyl-L-glutamine","C13H16N2O4","C04148","6833"
"Glutaral","C5H8O2","C12518","582908"
"Tetracaine","C15H24N2O2","C07526","9729"
"N-Acetyl-L-glutamate 5-phosphate","C7H12NO8P","C04133","6819"
"N-Acetyl-D-glucosamine 6-sulfate","C8H15NO9S","C04132","6818"
"N(alpha)-gamma-L-Glutamylhistamine","C10H16N4O3","C04138","6824"
"N2-(D-1-Carboxyethyl)-L-arginine","C9H18N4O4","C04137","6823"
"all-trans-Nonaprenyl diphosphate","C45H76O7P2","C04145","6830"
"Tetrahydropteroyltri-L-glutamate","C24H34N8O12","C04144","6829"
"alpha-D-Glucosyl-(1,3)-D-mannose","C12H22O11","C04147","6832"
"all-trans-Octaprenyl diphosphate","C40H68O7P2","C04146","6831"
"Midazolam","C18H13ClFN3","C07524","9727"
"Bupivacaine","C18H28N2O","C07529","9732"
"Etidocaine","C17H28N2O","C07530","9733"
"D-Ornaline","C10H18N2O6","C01683","4825"
"8-(1,1-Dimethylallyl)-3-methylgalangin","C21H20O5","C11579","13744"
"D-Rhamnose","C6H12O5","C01684","4826"
"Tauroursocholic acid","C26H45NO7S","",""
"Mepivacaine","C15H22N2O","C07528","9731"
"D-Fuconate","C6H12O6","C01680","4823"
"Eupacunolin","C22H28O8","C09428","11619"
"D-Nopaline","C11H20N4O6","C01682","4824"
"Loracarbef","C16H18ClN3O5","C08109","10309"
"Cefuroxime sodium","C16H15N4NaO8S","C08108","10308"
"Cefuroxime axetil","C20H22N4O10S","C08107","10307"
"Cefoxitin sodium","C16H16N3NaO7S2","C08106","10306"
"Cefonicid sodium","C18H16N6Na2O8S3","C08105","10305"
"Cefmetazole sodium","C15H16N7NaO5S3","C08104","10304"
"Cefmetazole","C15H17N7O5S3","C08103","10303"
"Cefamandole nafate","C19H17N6NaO6S2","C08102","10302"
"Cephapirin sodium","C17H16N3NaO6S2","C08101","10301"
"Cephalothin sodium","C16H15N2NaO6S2","C08100","10300"
"Destomysin","C20H37N3O13","C01688","4829"
"Undecanedioic acid","C11H20O4","","24171"
"Diclofenac","C14H11Cl2NO2","C01690","4831"
"Piperideine","C5H9N","C06181","8432"
"Pelletierine","C8H15NO","C06182","8433"
"Anapheline","C13H24N2O","C06183","8434"
"N-Methylpelletierine","C9H17NO","C06184","8435"
"Slaframine","C12H20N2O3","C06185","8436"
"Arbutin","C12H16O7","C06186","8437"
"Arbutin 6-phosphate","C12H17O10P","C06187","8438"
"Salicin 6-phosphate","C13H19O10P","C06188","8439"
"Cyclic 2,3-bisphospho-D-glycerate","C3H6O9P2","C06189","8440"
"2-(Hydroxymethyl)phenol","C7H8O2","C06191","8441"
"Schottenol","C29H50O","C08839","11032"
"alpha-Spinasterol","C29H48O","C08840","11033"
"7-Dehydrologanin tetraacetate","C25H32O14","C11668","13833"
"Deutzioside pentaacetate","C25H32O14","C11669","13834"
"Epothilone A","C26H39NO6S","C12153","14300"
"Limonene-1,2-epoxide","C10H16O","C07271","9480"
"L-Threonine O-3-phosphate","C4H10NO6P","C12147","14294"
"Stigmatellin A","C30H42O7","C12148","14295"
"2-Aminoacridone","C13H10N2O","C12143","14290"
"Phytosphingosine","C18H39NO3","C12144","14291"
"Mycolactone","C44H70O9","C12151","14298"
"Nitroprusside","C5FeN6O-6","C07269","9478"
"Stigmatellin X","C28H38O6","C12149","14296"
"Nifedipine","C17H18N2O6","C07266","9475"
"4-Methylaminobutanal","C5H11NO","C10974","13157"
"Aspidin","C25H32O8","C10672","12855"
"Achillin","C15H18O3","C09287","11478"
"(R)-5-Diphosphomevalonate","C6H14O10P2","C01143","4374"
"2,3',5-Trichlorobiphenyl","C12H7Cl3","C14358","179292"
"2,3,6-Trichlorobiphenyl","C12H7Cl3","C14359","182262"
"6-Bromo-2-naphthol","C10H7BrO","C14352","169774"
"1,1'-Biphenyl, chloro-","C12H9Cl","C14353","175615"
"2,2-Bis(4-hydroxyphenyl)hexafluoropropane","C15H10F6O2","C14350","216100"
"4-Butoxyphenol","C10H14O2","C14351","173269"
"3,5-Dichlorobiphenyl","C12H8Cl2","C14356","178411"
"2,3,4-Trichlorobiphenyl","C12H7Cl3","C14357","182263"
"2,5-Dichlorobiphenyl","C12H8Cl2","C14354","178410"
"2,6-Dichlorobiphenyl","C12H8Cl2","C14355","177858"
"Guanadrel","C10H19N3O2","C07035","9247"
"Guanabenz","C8H8Cl2N4","C07034","9246"
"Guanfacine","C9H9Cl2N3O","C07037","9249"
"Guanethidine","C10H22N4","C07036","9248"
"Hydromorphone","C17H19NO3","C07042","9254"
"Hydralazine","C8H8N4","C07040","9252"
"Hydroxyurea","CH4N2O2","C07044","9256"
"Hydroxychloroquine","C18H26ClN3O","C07043","9255"
"Imipramine","C19H24N2","C07049","9261"
"Hydroxyzine","C21H27ClN2O2","C07045","9257"
"Euphol","C30H50O","C08624","10817"
"Lunamarine","C18H15NO4","C10713","12896"
"Griseofulvin","C17H17ClO6","C06686","8911"
"indolylmethyl-desulfo-glucosinolate","C16H20N2O6S","",""
"dihydrozeatin-9-N-glucoside","C16H25N5O6","",""
"dihydrozeatin-7-N-dihydrozeatin","C16H25N5O6","",""
"2,3-dimethyl-6-phytyl-1,4-benzoquinone","C28H48O2","",""
"trans-zeatin-9-N-glucoside","C16H23N5O6","",""
"indolylmethylthiohydroximate","C10H10N2OS","",""
"kinetin-9-N-glucoside","C16H19N5O6","",""
"trans-zeatin-7-N-glucoside","C16H23N5O6","","3886835"
"kinetin-7-N-glucoside","C16H19N5O6","",""
"2-(2'-methylthio)ethylmalic-acid","C7H12O5S","",""
"Biotinyl-5'-AMP","C20H28N7O9PS","C05921","8209"
"L-Selenocysteine","C3H7NO2Se","C02432","5459"
"11-cis-Dehydroretinal","C20H26O","C05919","8207"
"L-Homocitrulline","C7H15N3O3","C02427","5455"
"L-Glyceraldehyde","C3H6O3","C02426","5454"
"Isonicotineamide","C6H6N2O","C02421","5452"
"Isobutyronitrile","C4H7N","C02420","5451"
"Hypotaurocyamine","C3H10N3O3S+","C02419","5450"
"Lemobiline","C15H17NO2","C10705","12888"
"Glutaconyl-1-CoA","C26H40N7O19P3S","C02411","5444"
"Formylkynurenine","C11H12N2O4","C02406","5439"
"Dydrogesterone","C21H28O2","C12617","583007"
"4-Sulfobenzyl alcohol","C7H8O4S","C06678","8903"
"11-Hydroxycanthin-6-one","C14H8N2O2","C09212","11403"
"Glybuzole","C12H15N3O2S2","C12610","583000"
"Cycloheximide","C15H23NO4","C06685","8910"
"Aluminum clofibrate","C20H27AlCl2O7","C12608","582998"
"Febuxostat","C16H16N2O3S","C12606","582996"
"Tobicillin","C27H30N2O6S","C12614","583004"
"Tolvaptan","C26H25ClN2O3","C12613","583003"
"Simfibrate","C23H26Cl2O6","C12612","583002"
"Valinomycin","C54H90N6O18","C06684","8909"
"all-trans-Dehydroretinal","C20H26O","C05918","8206"
"(3Z)-Phytochromobilin","C33H36N4O6","C05913","8201"
"Harman","C12H10N2","C09209","11400"
"Fridamycin E","C19H16O7","C12451","582841"
"Eschscholtzidine","C20H21NO4","C09426","11617"
"DCI","C11H15Cl2NO","C11772","13936"
"FADH2","C27H35N9O15P2","C01352","4556"
"Carbonic acid","CH2O3","C01353","4557"
"Salmefamol","C19H25NO4","C11771","13935"
"dUDP","C9H14N2O11P2","C01346","4551"
"dXDP","C10H14N4O11P2","C01347","4552"
"dXTP","C10H15N4O14P3","C01348","4553"
"AA861","C21H26O3","C01349","4554"
"XDP","C10H14N4O12P2","C01337","4545"
"E-64","C15H27N5O5","C01341","4546"
"dIDP","C10H14N4O10P2","C01344","4549"
"dITP","C10H15N4O13P3","C01345","4550"
"Jesaconitine","C35H49NO12","C08692","10885"
"Karakoline","C22H35NO4","C08693","10886"
"Acetylpseudotropine","C10H17NO2","C12453","582843"
"Brinzolamide","C12H21N3O5S3","C07760","9962"
"Farnesyl triphosphate","C15H29O10P3","C03115","6010"
"Finaconitine","C33H46N2O10","C08684","10877"
"Garryine","C22H33NO2","C08685","10878"
"Heteratisine","C22H33NO5","C08686","10879"
"Hetisine","C20H27NO3","C08687","10880"
"Hypaconitine","C33H45NO10","C08688","10881"
"Icaceine","C22H33NO4","C08689","10882"
"Icacine","C22H31NO6","C08690","10883"
"Bendroflumethiazide","C15H14F3N3O4S2","C07758","9960"
"Phosphoribosyl-ATP","C15H25N5O20P4","C02739","5699"
"Alendronic acid","C4H13NO7P2","C07752","9954"
"Phosphoribosyl-AMP","C15H23N5O14P2","C02741","5701"
"Ibutilide","C20H36N2O3S","C07753","9955"
"L-Aspartylhydroxamate","C4H8N2O4","C03124","6017"
"Imazaquin","C17H17N3O3","C05076","7524"
"Nalidixic acid","C12H12N2O3","C05079","7525"
"Novobiocin","C31H36N2O11","C05080","7526"
"Cyclosporin A","C62H111N11O12","C05086","7528"
"3-Ureidoisobutyrate","C5H10N2O3","C05100","7529"
"4alpha-Methylzymosterol","C28H46O","C05103","7531"
"delta7,24-Cholestadien-3beta-ol","C27H44O","C05104","7532"
"7-Dehydrodesmosterol","C27H42O","C05107","7533"
"Thymol","C10H14O","C09908","12094"
"24,25-Dihydrolanosterol","C30H52O","C05109","7535"
"Thujone","C10H16O","C09906","12092"
"gamma-Thujaplicin","C10H12O2","C09905","12091"
"beta-Thujaplicin","C10H12O2","C09904","12090"
"Spirolucidine","C30H49N3O2","C09903","12089"
"(R)-(+)-alpha-Terpineol","C10H18O","C09902","12088"
"2-Succinylbenzoate","C11H10O5","C02730","5692"
"N4-Phosphoagmatine","C5H15N4O3P","C02726","5688"
"alpha-D-Mannose","C6H12O6","C00936","4188"
"(R)-Lactaldehyde","C3H6O2","C00937","4189"
"Sinapoylcholine","C16H24NO5+","C00933","4185"
"UDP-L-arabinose","C14H22N2O16P2","C00935","4187"
"Mercaptoethanol","C2H6OS","C00928","4181"
"Porphobilinogen","C10H14N2O4","C00931","4184"
"Ferrocytochrome","C33H32FeN4O4","C00924","4178"
"Isonocardicin A","C23H24N4O9","C00927","4180"
"Dimethylmaleate","C6H8O4","C00922","4176"
"Ferricytochrome","C33H32FeN4O4+","C00923","4177"
"Sphingosine 1-phosphate","C18H38NO5P","C06124","8381"
"5-Dehydro-4-deoxy-D-glucarate","C6H8O7","C00679","3948"
"Cichoriin","C15H16O9","C09206","11397"
"14-Demethyllanosterol","C29H48O","C05108","7534"
"2-Methylprop-2-enoyl-CoA","C25H40N7O17P3S","C03460","6280"
"2-Hydroxy-3-oxosuccinate","C4H4O6","C03459","6279"
"3''-Adenylylstreptomycin","C31H51N12O18P","C03462","6282"
"5-Androstenetriol","C19H30O3","","728729"
"2-trans,6-trans-Farnesal","C15H24O","C03461","6281"
"3L,7D,11D-Phytanic acid","C29H40O2","",""
"3-Methyladipic acid","C7H12O4","","266024"
"(+)-Epicatechin","C15H14O6","C09728","11916"
"(-)-Epicatechin","C15H14O6","C09727","11915"
"Seiricardine A","C15H26O2","C09722","11910"
"Sclerosporin","C15H22O2","C09721","11909"
"beta-Santalol","C15H24O","C09720","11908"
"alpha-Santalol","C15H24O","C09719","11907"
"Dracorubin","C32H24O5","C09726","11914"
"Shiromodiol diacetate","C19H30O5","C09725","11913"
"6,8-Diprenylnaringenin","C25H28O5","C09724","11912"
"beta-Selinene","C15H24","C09723","11911"
"5,8-Tetradecadienoic acid","C14H24O2","","729059"
"Procollagen 5-(D-galactosyloxy)-L-lysine","C12H24N2O8","C05547","7883"
"N-Acetyl-L-2-amino-6-oxopimelate","C9H13NO6","C05539","7878"
"Penicillin G","C16H18N2O4S","C05551","7885"
"6-Acetamido-2-oxohexanoate","C8H13NO4","C05548","7884"
"3-Sulfopyruvate","C3H4O6S","C05528","7871"
"3-Sulfinylpyruvate","C3H4O5S","C05527","7870"
"N-Succinyl-2-amino-6-oxopimelate","C11H15NO8","C05537","7877"
"Oxaloglutarate","C7H8O7","C05533","7875"
"Benoxacor","C11H11Cl2NO2","C10964","13147"
"Bentazone","C10H12N2O3S","C10965","13148"
"Sarisan","C11H12O3","C10493","12676"
"[6]-Shogaol","C17H24O3","C10494","12677"
"Aerobactin","C22H36N4O13","C05554","7887"
"N6-D-Biotinyl-L-lysine","C16H28N4O4S","C05552","7886"
"DMPP","C12H19IN2","C07488","9691"
"Glutethimide","C13H15NO2","C07489","9692"
"Oxotremorine","C12H18N2O","C07485","9688"
"Nordazepam","C15H11ClN2O","C07486","9689"
"Montelukast","C35H36ClNO3S","C07482","9685"
"Zaleplon","C17H15N5O","C07484","9687"
"Theobromine","C7H8N4O2","C07480","9683"
"Caffeine","C8H10N4O2","C07481","9684"
"N-Cyclohexylformamide","C7H13NO","C11519","13687"
"2-(alpha-D-Mannosyl)-3-phosphoglycerate","C9H17O12P","C11516","13686"
"Trichloroethanol","C2H3Cl3O","C07490","9693"
"Carbaril","C12H11NO2","C07491","9694"
"1,1,1-Trichloro-2,2-bis(4-chlorophenyl)ethane","C14H9Cl5","C04623","7213"
"2,4-Dichloro-2,5-dihydro-5-oxofuran-2-acetate","C6H4Cl2O4","C04625","7215"
"N-(7-Mercaptoheptanoyl)threonine 3-O-phosphate","C11H22NO7PS","C04628","7217"
"Trimethylamine(alkyl-substituted derivatives)","C3H9N","C04629","7218"
"UDP-2-acetamido-4-dehydro-2,6-dideoxyglucose","C17H25N3O16P2","C04613","7204"
"(1S,2S)-1-Hydroxypropane-1,2,3-tricarboxylate","C6H8O7","C04617","7207"
"(E)-2-(2-Furyl)-3-(5-nitro-2-furyl)acrylamide","C11H8N2O5","C04621","7211"
"(Z)-2-(2-Furyl)-3-(5-nitro-2-furyl)acrylamide","C11H8N2O5","C04622","7212"
"UDP-2-acetamido-4-amino-2,4,6-trideoxyglucose","C17H28N4O15P2","C04630","7219"
"UDP-N-acetyl-3-(1-carboxyvinyl)-D-glucosamine","C20H29N3O19P2","C04631","7220"
"unsym-Bis(4'-chlorophenyl)ethylene","C14H10Cl2","C06642","8868"
"Bis(4'-chlorophenyl)methane","C13H10Cl2","C06641","8867"
"Bis(4'-chlorophenyl)acetate","C14H10Cl2O2","C06640","8866"
"2,2-Bis(4'-chlorophenyl)ethanol","C14H12Cl2O","C06639","8865"
"1-Chloro-2,2-bis(4'-chlorophenyl)ethane","C14H11Cl3","C06638","8864"
"1-Chloro-2,2-bis(4'-chlorophenyl)ethylene","C14H9Cl3","C06637","8863"
"1,1-Dichloro-2,2-bis(4'-chlorophenyl)ethane","C14H10Cl4","C06636","8862"
"Erythronolide B","C21H38O7","C06635","8861"
"1,1-Dichloro-2-(dihydroxy-4'-chlorophenyl)-2-(4'-chlorophenyl)ethylene","C14H8Cl4O2","C06644","8870"
"4,4'-Dichlorobenzophenone","C13H8Cl2O","C06643","8869"
"Narwedine","C17H19NO3","C08534","10727"
"Aklaviketone","C22H18O8","C12423","582813"
"Fructose 1-phosphate(furanose)","C6H13O9P","C05000","7487"
"Fructose(pyranose)","C6H12O6","C05003","7489"
"Pentylenetetrazole","C6H10N4","C13692","586281"
"4,5,6,7-Tetrahydroisoxazolo(5,4-c)pyridin-3-ol","C6H8N2O2","C13693","586282"
"Dopamine 3-O-sulfate","C8H11NO5S","C13690","586279"
"Dopamine 4-O-sulfate","C8H11NO5S","C13691","586280"
"delta-Guanidinovaleric acid","C6H13N3O2","C13688","586277"
"m-Benzenesulfonium diazonium chloride","C6H5ClN2O3S","C13689","586278"
"Azithromycin dihydrate","C38H76N2O14","C13686","854007"
"Cunaniol","C14H14O2","C13687","586276"
"Isoguvacine","C6H9NO2","C13694","586283"
"ZAPA","C4H6N2O2S","C13695","586284"
"Neburon","C12H16Cl2N2O","C11188","13369"
"Hoechst 33342","C27H28N6O","C11189","13370"
"Rhodamine 123","C21H17ClN2O3","C11190","13371"
"cis-(Z)-Flupenthixol","C23H25F3N2OS","C11191","13372"
"PMEG","C8H12N5O5P","C11184","13365"
"Nuarimol","C17H12ClFN2O","C11185","13366"
"Nonactin","C40H64O12","C11186","13367"
"Nimesulide","C13H12N2O5S","C11187","13368"
"(-)-Annonaine","C17H15NO2","C09339","11530"
"Prenylamine","C24H27N","C11192","13373"
"R (+)-Propanolol","C16H21NO2","C11193","13374"
"Protoemetine","C19H27NO3","C11816","13980"
"Isoalangiside","C25H31NO10","C11815","13979"
"Perindopril","C19H32N2O5","C07706","9908"
"Perindopril erbumine","C23H43N3O5","C07707","9909"
"Pioglitazone","C19H20N2O3S","C07675","9877"
"Acebutolol hydrochloride","C18H29ClN2O4","C07677","9879"
"Phenformin","C10H15N5","C07673","9875"
"Buformin","C6H15N5","C07674","9876"
"Nisoldipine","C20H24N2O6","C07699","9901"
"Moexipril","C27H34N2O7","C07704","9906"
"Fenoldopam","C16H16ClNO3","C07693","9895"
"Sodium nitroprusside dihydrate","C5H4FeN6Na2O3-4","C07695","9897"
"Leucomycin A7","C38H63NO14","C14060","854298"
"Leucomycin A8","C39H63NO15","C14061","854299"
"Mercaptopurine","C5H6N4OS","C13245","585989"
"Rolipram","C16H21NO3","C13251","585995"
"Proxyphylline","C10H14N4O3","C13239","585983"
"Ether","C4H10O","C13240","585984"
"Procaterol hydrochloride","C16H23ClN2O3","C13235","585979"
"Malotilate","C12H16O4S2","C13238","585982"
"Bifonazole","C22H18N2","C13243","585987"
"Antipyrine","C11H12N2O","C13244","585988"
"Oxatomide","C27H30N4O","C13241","585985"
"Adipiodone","C20H14I6N2O6","C13242","585986"
"Pancratistatin","C14H15NO8","C08535","10728"
"Antiarol","C9H12O4","C10765","12948"
"S-Succinyldihydrolipoamide","C12H21NO4S2","C01169","4396"
"Sulphuretin","C15H10O5","C08730","10923"
"Rosinidin","C17H15O6+","C08729","10922"
"Albafuran A","C24H26O4","C08732","10925"
"Xenognosin A","C16H16O3","C08731","10924"
"alpha-Terthienyl","C12H8S3","C08460","10653"
"Stearolic acid","C18H32O2","C08459","10652"
"Riccionidin A","C15H9O6+","C08728","10921"
"Petunidin","C16H13O7+","C08727","10920"
"Thiarubrine B","C13H8S2","C08462","10655"
"Thiarubrine A","C13H8S2","C08461","10654"
"2,4-Dihydroxy-6-amino-1,3,5-triazine","C3H4N4O2","C08734","10927"
"2-Hydroxy-4,6-diamino-1,3,5-triazine","C3H5N5O","C08733","10926"
"Grosshemin","C15H18O4","C09472","11663"
"Helenalin","C15H18O4","C09473","11664"
"Granilin","C15H20O4","C09470","11661"
"Asebogenin","C16H16O5","C09471","11662"
"Gradolide","C25H34O7","C09468","11659"
"Graminiliatrin","C22H26O9","C09469","11660"
"Glechomanolide","C15H20O2","C09466","11657"
"Goyazensolide","C19H20O7","C09467","11658"
"Pinocembrin","C15H12O4","C09827","12015"
"Pinocembrin 7-rhamnosylglucoside","C27H32O13","C09828","12016"
"Heliangin","C20H26O6","C09474","11665"
"Hiyodorilactone A","C22H28O8","C09475","11666"
"3-methylthiopropylhydroxamic-acid","C5H11NOS2","",""
"Chamazulene","C14H16","C09633","11823"
"22alpha-hydroxy-5alpha-campestan-3-one","C28H48O2","",""
"22alpha-hydroxy-campest-4-en-3-one","C28H46O2","",""
"22alpha-hydroxy-campesterol","C28H48O2","",""
"campest-5-en-3-one","C28H46O","",""
"CROTONOBETAINYL-COA","C28H48N8O17P3S","","2553"
"campest-4-en-3-one","C28H46O","",""
"E-pyridine-3-aldoxime","C6H6N2O","","157792"
"indole carboxyl tetrahydro-thiazole","C12H12N2O2S","",""
"Cypridina luciferin","C22H27N7O","C02825","5773"
"D-Glucose 6-sulfate","C6H12O9S","C02827","5774"
"Picolinamide","C6H6N2O","C01950","5053"
"Piperitenone","C10H14O","C01951","5054"
"Benzene-1,2,4-triol","C6H6O3","C02814","5764"
"Chlordecone alcohol","C10H2Cl10O","C02817","5767"
"Pentadecanal","C15H30O","C01948","5051"
"Ascorbate 2-sulfate","C6H8O9S","C02812","5762"
"Cyanocob(III)alamin","C63H89CoN14O14P+","C02823","5771"
"Cyclohexylsulfamate","C6H13NO3S","C02824","5772"
"Cortisol 21-acetate","C23H32O6","C02821","5769"
"Cortisol 21-sulfate","C21H30O8S","C02822","5770"
"beta-D-Mannose","C6H12O6","C02209","5277"
"Kawain","C14H14O3","C09947","12133"
"5-Methylthio-D-ribose","C6H12O4S","C03089","5987"
"5-Phosphoribosylamine","C5H12NO7P","C03090","5988"
"4-Chlorophenylacetate","C8H7ClO2","C03077","5975"
"4-Guanidinobutanamide","C5H12N4O","C03078","5976"
"4-Hydroxy-L-glutamate","C5H9NO5","C03079","5977"
"4-Hydroxyhydratropate","C9H10O3","C03080","5978"
"4-Methylumbelliferone","C10H8O3","C03081","5979"
"4-Phospho-L-aspartate","C4H8NO7P","C03082","5980"
"5-Acetamidopentanoate","C7H13NO3","C03087","5985"
"5-Hydroxymethyluracil","C5H6N2O3","C03088","5986"
"N-Acetylpuromycin","C24H31N7O6","C07032","9244"
"6-Deoxyjacareubin","C18H14O5","C10059","12245"
"3,5-Dimethoxy-1,6-dihydroxyxanthone","C15H12O6","C10060","12246"
"Isovitexin 2''-O-beta-D-glucoside","C27H30O15","C04199","6872"
"Indole-3-acetyl-beta-1-D-glucoside","C16H19NO7","C04197","6870"
"Flavonol 3-O-L-rhamnosylglucoside","C27H32O15","C04194","6867"
"Flavonol 3-O-D-xylosylgalactoside","C26H30O15","C04193","6866"
"Dihydrostreptomycin 3''-phosphate","C21H42N7O15P","C04191","6865"
"S-Methyl-5-thio-D-ribose 1-phosphate","C6H13O7PS","C04188","6864"
"5-Methyldeoxycytidine diphosphate","C10H17N3O10P2","C04187","6863"
"5-Carboxymethyl-2-hydroxymuconate","C8H8O7","C04186","6862"
"5,6-Dihydroxyindole-2-carboxylate","C9H7NO4","C04185","6861"
"4-Hydroxy-4-methyl-2-oxoglutarate","C6H8O6","C04184","6860"
"Cinchonine","C19H22N2O","C06528","8759"
"Cupreine","C19H22N2O2","C06530","8760"
"alpha-Erythroidine","C16H19NO3","C06531","8761"
"beta-Erythroidine","C16H19NO3","C06532","8762"
"Papaverine","C20H21NO4","C06533","8763"
"Heroin","C21H23NO5","C06534","8764"
"Physostigmine","C15H21N3O2","C06535","8765"
"Harmaline","C13H14N2O","C06536","8766"
"Harmalol","C12H10N2O","C06537","8767"
"Harmine","C13H12N2O","C06538","8768"
"Templetine","C20H35N3","C10786","12969"
"(15:1)-Cardanol","C21H34O","C10785","12968"
"Gentisyl alcohol","C7H8O3","C10792","12975"
"Tsukushinamine A","C15H20N2O","C10791","12974"
"Tinctorine","C15H20N2O","C10790","12973"
"Thermospine","C15H20N2O","C10789","12972"
"D-Glucuronate 1-phosphate","C6H11O10P","C05385","7759"
"GDP-6-deoxy-L-mannose","C16H25N5O15P2","C05386","7760"
"GDP-4-oxo-L-fucose","C16H23N5O15P2","C05389","7761"
"Terbinafine","C21H25N","C08079","10279"
"Sulconazole","C18H15Cl3N2S","C08076","10276"
"Tioconazole","C16H13Cl3N2OS","C08082","10282"
"Terconazole","C26H31Cl2N5O3","C08080","10280"
"Natamycin","C33H47NO13","C08073","10273"
"Naftifine hydrochloride","C21H22ClN","C08072","10272"
"Oxiconazole nitrate","C18H14Cl4N4O4","C08075","10275"
"Oxiconazole","C18H13Cl4N3O","C08074","10274"
"Nicotinurate","C8H8N2O3","C05380","7754"
"Tetracenomycin D1","C19H12O6","C12376","582766"
"Tetracenomycin B1","C20H14O6","C12377","582767"
"Amprenavir","C25H35N3O6S","C08086","10286"
"Abacavir sulfate","C28H38N12O6S","C08083","10283"
"3-Carboxy-1-hydroxypropyl-ThPP","C16H25N4O10P2S+","C05381","7755"
"D-Sedoheptulose 7-phosphate","C7H15O10P","C05382","7756"
"D-Ribitol","C5H12O5","C05384","7758"
"2-Amino-5-phosphopentanoic acid","C5H12NO5P","C13734","586323"
"(S)-ATPA","C10H16N2O4","C13733","586322"
"Lunacridine","C17H23NO4","C10710","12893"
"Calicheamicin gamma(1)I","C55H74IN3O21S4","C11469","13640"
"Dynemicin A","C30H19NO9","C11471","13641"
"dTDP-4-amino-4,6-dideoxy-5-C-methyl-L-mannose","C17H29N3O14P2","C11461","13632"
"3-Hydroxy-L-tyrosyl-AMP","C19H23N6O10P","C11462","13633"
"Butyro-betaine","C8H18NO+","C11459","13630"
"dTDP-4-oxo-5-C-methyl-L-rhamnose","C17H26N2O15P2","C11460","13631"
"N-Pyruvoyl-5-methoxy-3-hydroxyanthranilate","C11H11NO6","C11467","13638"
"3,4-Dihydro-7-methoxy-2-methylene-3-oxo-2H-1,4-benzoxazine-5-carboxylic acid","C11H9NO5","C11468","13639"
"3,5-Dihydroxyanthranilate","C7H7NO4","C11465","13636"
"5-Methoxy-3-hydroxyanthranilate","C8H9NO4","C11466","13637"
"Fetidine","C40H46N2O8","C09441","11632"
"Domoic acid","C15H21NO6","C13732","586321"
"Aucubin","C15H22O9","C09771","11959"
"NS-102","C12H11N3O4","C13731","586320"
"Eupatoroxin","C20H24O8","C09443","11634"
"Ethambutol","C10H24N2O2","C06984","9198"
"2,3,9,10-Tetrahydroxyberbine","C17H17NO4","C12330","582720"
"Eupatoriopicrin","C20H26O6","C09442","11633"
"2,3,9,10-Tetrahydroxyberberine","C17H14NO4+","C12331","582721"
"Didrovaltratum","C22H32O8","C09776","11964"
"Militarinone D","C26H31NO4","C12332","582722"
"Catalposide","C22H26O12","C09775","11963"
"Militarinone A","C26H37NO6","C12333","582723"
"2'-O-Methylodoratol","C18H20O5","C09774","11962"
"Militarinone B","C26H33NO5","C12334","582724"
"Catalpol","C15H22O10","C09773","11961"
"Cerberoside","C42H66O18","C12091","14240"
"Friedelin","C30H50O","C08626","10819"
"Dioncophylline A","C24H27NO3","C12336","582726"
"Asperlicin","C31H29N5O4","C11688","13853"
"Curacin A","C23H35NOS","C11689","13854"
"Uracil mustard","C8H11Cl2N3O2","C11686","13851"
"Aziridine","C2H5N","C11687","13852"
"MET-enkephalin","C27H35N5O7S","C11684","13849"
"Clorgyline","C13H15Cl2NO","C11685","13850"
"Tetrahydroalstonine","C21H24N2O3","C11682","13847"
"19-epi-Ajmalicine","C21H24N2O3","C11683","13848"
"Cathenamine","C21H22N2O3","C11680","13845"
"19-epi-Cathenamine","C21H22N2O3","C11681","13846"
"Fernene","C30H50","C08625","10818"
"Lupeol acetate","C32H52O2","C08630","10823"
"Messagenin","C30H50O2","C08631","10824"
"(4Z,7Z,10Z,13Z,16Z,19Z)-Docosahexaenoic acid","C22H32O2","C06429","8664"
"Lupeol","C30H50O","C08628","10821"
"Cyanidin 3,5,3'-tri-O-glucoside","C33H41O21+","C08629","10822"
"2,6-Dimethylnaphthalene","C12H12","C14330","154691"
"4-Chloro-m-cresol","C7H7ClO","C14331","148911"
"Metribuzin","C8H14N4OS","C14332","172606"
"Pronamide","C12H11Cl2NO","C14333","174154"
"Propoxur","C11H15NO3","C14334","151373"
"Pyrene","C16H10","C14335","173502"
"1,2-Dibromo-3-chloropropane","C3H5Br2Cl","C14336","150331"
"Bioallethrin","C19H26O3","C14337","154746"
"Pentachloronitrobenzene","C6Cl5NO2","C14338","149700"
"3,3'-Dimethylbisphenol A","C17H20O2","C14339","149594"
"Testosterone glucuronide","C25H36O8","C11134","13316"
"Styrene cis-glycol","C8H10O2","C07084","9295"
"Styrene","C8H8","C07083","9294"
"Loperamide","C29H33ClN2O2","C07080","9291"
"Androsterone glucuronide","C25H38O8","C11135","13317"
"Lindane","C6H6Cl6","C07075","9286"
"Losartan","C22H23ClN6O","C07072","9283"
"Levamisole","C11H12N2S","C07070","9282"
"Levallorphan","C19H25NO","C07069","9281"
"Casimiroedine","C21H27N3O6","C10577","12760"
"Phenylacetic acid","C8H8O2","C07086","9297"
"3-Vinylcatechol","C8H8O2","C07085","9296"
"1,3-Dihydro-3-hydroxy-2H-indol-2-one","C8H7NO2","C11130","13312"
"2-Methoxy-estradiol-17beta 3-glucuronide","C25H34O9","C11131","13313"
"7-Methylguanosine 5'-phosphate","C11H17N5O8P+","C03998","6711"
"Benzyl 2-methyl-3-oxobutanoate","C12H14O3","C04000","6713"
"Wilfordine","C43H49NO19","C09992","12178"
"Xanthomicrol","C18H16O7","C14476","215448"
"3,3-Difluoro-5alpha-androstan-17beta-yl acetate","C21H32F2O2","C14477","104256"
"21-Deoxycortisone","C21H28O4","C14478","679598"
"Flumethasone","C22H28F2O5","C14479","159728"
"4',5,6,7-Tetramethoxyflavone","C19H18O6","C14472","673315"
"1(2H)-Phthalazinone","C8H6N2O","C14473","151542"
"2-Ethyl-3-(4'-hydroxybenzoyl)benzofuran","C17H14O3","C14474","158446"
"Bolasterone","C21H32O2","C14475","679568"
"Amphibine B","C39H47N5O5","C09998","12184"
"5-Diazouracil","C4H2N4O2","C14480","215504"
"1-Hydroxy-2-acetamidofluorene","C15H13NO2","C14481","160864"
"Amphibine A","C33H43N5O4","C09997","12183"
"alpha-L-Rhamnose","C6H12O5","C02476","5491"
"Xanthurenic acid","C10H7NO4","C02470","5485"
"beta-L-Arabinose","C5H10O5","C02479","5494"
"alpha-Tocopherol","C29H50O2","C02477","5492"
"Triiodothyronine","C15H12I3NO4","C02465","5481"
"Precorrin 2","C42H48N4O16","C02463","5480"
"Uroporphyrin III","C40H38N4O16","C02469","5484"
"UDPgalactosamine","C15H25N3O16P2","C02467","5483"
"Adouetine Z","C42H45N5O5","C09995","12181"
"gamma-Tocopherol","C28H48O2","C02483","5496"
"cis,cis-Muconate","C6H6O4","C02480","5495"
"Blonanserin","C23H30FN3","C12576","582966"
"Pheniramine maleate","C20H24N2O4","C12574","582964"
"Iobitridol","C20H28I3N3O9","C12581","582971"
"Trilostane","C20H27NO3","C12580","582970"
"Octotiamine","C23H36N4O5S3","C12584","582974"
"Tolfenamic acid","C14H12ClNO2","C12583","582973"
"Pimilprost","C23H40O5","C12588","582978"
"Stevioside","C38H60O18","C09189","11381"
"Pheneturide","C11H14N2O2","C12590","582980"
"Metiazinic acid","C15H13NO2S","C12589","582979"
"(S)-2-Hydroxystearate","C18H36O3","C03045","5948"
"Fruticosonine","C20H28N2O","C09191","11383"
"Shikodonin","C20H26O6","C09184","11376"
"Simplexin","C30H44O8","C09185","11377"
"Chloroquine","C18H26ClN3","C07625","9827"
"beta-L-Oleandropyranose","C7H14O4","C08237","10436"
"Candletoxin A","C35H44O9","C09068","11260"
"UDP-N-acetylmuramoyl-L-alanyl-D-glutamate","C28H43N5O23P2","C00692","3960"
"Evodiamine","C19H17N3O","C09187","11379"
"XTP","C10H15N4O15P3","C00700","3968"
"(5Z,13E)-(15S)-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate","C20H32O5","C00696","3964"
"Malate","C4H6O5","C00711","3977"
"dCDP","C9H15N3O10P2","C00705","3972"
"Panose","C18H32O16","C00713","3979"
"Sorbose","C6H12O6","C01452","4629"
"Dimethylallyl diphosphate","C5H12O7P2","C00235","3534"
"Octane","C8H18","C01387","4581"
"Quercetin 3-sulfate","C15H10O10S","C00616","3890"
"UDP-D-galacturonate","C15H22N2O18P2","C00617","3891"
"NH2Mec","C10H9NO2","C01386","4580"
"AACOCF3","C21H31F3O","C01397","4587"
"Alanine","C3H7NO2","C01401","4590"
"Dimethylamine","C2H7N","C00543","3824"
"Homogentisate","C8H8O4","C00544","3825"
"Pyridoxine phosphate","C8H12NO6P","C00627","3900"
"2,5-Dihydroxybenzoate","C7H6O4","C00628","3901"
"Anisole","C7H8O","C01403","4592"
"Arg-OEt","C8H18N4O2","C01404","4593"
"L-Arabitol","C5H12O5","C00532","3814"
"Pyridoxamine","C8H12N2O2","C00534","3816"
"Hydroquinone","C6H6O2","C00530","3812"
"Itaconyl-CoA","C26H40N7O19P3S","C00531","3813"
"Astragaloside III","C41H68O14","C08924","11116"
"Astrasieversianin XVI","C47H78O18","C08925","11117"
"Avenacin A-1","C55H83NO21","C08926","11118"
"Avenacin B-2","C54H80O20","C08927","11119"
"UDPglucosamine","C15H25N3O16P2","C02200","5268"
"alpha-Pyrufuran","C15H14O5","C08929","11121"
"Cuauchichicine","C22H33NO2","C08672","10865"
"14-Deacetylnudicauline","C36H48N2O10","C08673","10866"
"Cassaine","C24H39NO4","C08670","10863"
"Condelphine","C25H39NO6","C08671","10864"
"Cashmiradelphine","C37H52N2O11","C08668","10861"
"Cassaidine","C24H41NO4","C08669","10862"
"Cammaconine","C23H37NO5","C08666","10859"
"Cardiopetalidine","C21H33NO4","C08667","10860"
"Bikhaconitine","C36H51NO11","C08664","10857"
"Browniine","C25H41NO7","C08665","10858"
"Cyhalothrin","C23H19ClF3NO3","C10983","13166"
"Magellanine","C17H25NO2","C09886","12072"
"(+)-Piperitone","C10H16O","C09885","12071"
"Megastachine","C20H29NO3","C09888","12074"
"Piquerol A","C10H14O2","C09887","12073"
"beta-Pinene","C10H16","C09882","12068"
"Imidazole-4-acetaldehyde","C5H6N2O","C05130","7550"
"Pinocarvone","C10H14O","C09884","12070"
"Lycopodine","C16H25NO","C09883","12069"
"beta-Obscurine","C17H24N2O","C09890","12076"
"alpha-Obscurine","C17H26N2O","C09889","12075"
"4-(beta-Acetylaminoethyl)imidazole","C7H11N3O","C05135","7555"
"GDP-3,6-dideoxy-D-galactose","C16H25N5O14P2","C05136","7556"
"Sterigmatocystin","C18H12O6","C00961","4212"
"beta-D-Galactose","C6H12O6","C00962","4213"
"(-)-trans-Carveol","C10H16O","C00964","4215"
"2-Dehydropantoate","C6H10O4","C00966","4217"
"Indole-3-ethanol","C10H11NO","C00955","4206"
"L-2-Aminoadipate","C6H11NO4","C00956","4207"
"Mercaptopyruvate","C3H4O3S","C00957","4208"
"Prostaglandin B1","C20H32O4","C00959","4210"
"3',5'-Cyclic dAMP","C10H12N5O5P","C00968","4218"
"3-Hydroxypropanal","C3H6O2","C00969","4219"
"(9Z)-(12S)-Hydroxyoctadecenoic acid","C18H34O3","C08365","10561"
"N1-Acetylspermine","C12H28N4O","C02567","5564"
"(11E)-Octadecenoic acid","C18H34O2","C08367","10563"
"Carpaine","C28H50N2O4","C10135","12321"
"Buchananine","C12H15NO7","C10134","12320"
"Brunfelsamidine","C5H7N3","C10133","12319"
"Guanidinoethyl methyl phosphate","C4H12N3O4P","C04071","6766"
"Cryptophorine","C17H27NO","C10139","12325"
"gamma-Coniceine","C8H15N","C10138","12324"
"Codonopsine","C14H21NO4","C10137","12323"
"Cassine","C18H35NO2","C10136","12322"
"Methylmalonyl-CoA","C25H40N7O19P3S","C02557","5558"
"Deoxymannojirimycin","C6H13NO4","C10141","12327"
"Cucurbitine","C5H10N2O2","C10140","12326"
"Isoflavone 7-O-beta-D-glucoside","C21H20O8","C04074","6769"
"L-2-Amino-4-chloropent-4-enoate","C5H8ClNO2","C04075","6770"
"N-Acetylarylamine","C8H9NO","C02558","5559"
"Kievitone hydrate","C20H22O7","C02549","5553"
"Acetylagmatine","C7H16N4O","C02131","5210"
"Luciferyl sulfate","C26H21N3O6S","C02555","5556"
"Inabenfide","C19H15ClN2O2","C10942","13125"
"NADP+","C21H28N7O17P3","C00006","3308"
"Epicainide","C21H26N2O2","C10940","13123"
"Furalaxyl","C17H19NO4","C10941","13124"
"N,N-Diethylphenylacetamide","C12H17NO","C10938","13121"
"N-Ethyl-N-methyl-4-(trifluoromethyl)-2-(3,4-dimethoxyphenyl)benzamide","C19H20F3NO3","C10939","13122"
"N-(2,6-Dimethylphenyl)-4-[[(diethylamino)acetyl]amino]benzamide","C21H27N3O2","C10936","13119"
"Bensulfuron methyl","C16H18N4O7S","C10937","13120"
"CoA","C21H36N7O16P3S","C00010","3312"
"Isobutylphendienamide","C16H21NO","C10944","13127"
"Caffeic aldehyde","C9H8O3","C10945","13128"
"2beta-Hydroxygibberellin 1","C19H24O7","C03579","6371"
"3''-Adenylylspectinomycin","C24H36N7O13P","C03580","6372"
"sn-3-O-(Geranylgeranyl)glycerol 1-phosphate","C23H41O6P","C04590","7189"
"Toluene-cis-dihydrodiol","C7H10O2","C04592","7190"
"Co-Methyl-Co-5-hydroxybenzimidazolylcob(I)amide","C60H89CoN13O15P-7","C04665","7248"
"5-Methylthio-5-deoxy-D-ribulose 1-phosphate","C6H13O7PS","C04582","7183"
"6-Hydroxyl-1,6-dihydropurine ribonucleoside","C10H14N4O5","C04583","7184"
"2-Amino-2-methylbutanoate","C5H11NO2","C03571","6363"
"2-Chloro-cis,cis-muconate","C6H5ClO4","C03572","6364"
"2-Formylaminobenzaldehyde","C8H7NO2","C03574","6366"
"UDP-N-acetyl-D-galactosamine 4,6-bissulfate","C17H27N3O23P2S2","C04589","7188"
"6-Imino-5-oxocyclohexa-1,3-dienecarboxylate","C7H5NO3","C04584","7185"
"Diethyl (2R,3R)-2-methyl-3-hydroxysuccinate","C9H16O5","C04586","7186"
"3alpha,7alpha,12beta-Trihydroxy-5beta-cholanate","C24H40O5","C04661","7245"
"NADH","C21H29N7O14P2","C00004","3306"
"Taurolithocholate sulfate","C26H45NO8S2","C03642","6424"
"NAD+","C21H27N7O14P2","C00003","3305"
"Bis-gamma-glutamylcystine","C16H26N4O10S2","C03646","6427"
"3-Propylmalate","C7H12O5","C02123","5202"
"Clavamycin A","C16H22N4O9","C06667","8892"
"Imipenem","C12H17N3O4S","C06665","186607"
"3-Deoxy-D-manno-octulosonyl-lipid IV(A)","C76H142N2O30P2","C06024","8296"
"UDP-3-O-(3-hydroxytetradecanoyl)-D-glucosamine","C29H51N3O18P2","C06022","8294"
"Clavulanate-9-aldehyde","C8H7NO5","C06661","8886"
"Clavaminic acid","C8H10N2O4","C06660","8885"
"dTDP-D-glucuronate","C16H24N2O17P2","C06017","8289"
"Clavulanic acid","C8H9NO5","C06662","8887"
"Guanidinoproclavaminic acid","C9H16N4O4","C06657","8882"
"Deoxyguanidinoproclavaminic acid","C9H16N4O3","C06656","8881"
"Dihydroclavaminic acid","C8H12N2O4","C06659","8884"
"Proclavaminic acid","C8H14N2O4","C06658","8883"
"Tubeimoside I","C63H98O29","C08987","11179"
"Spinasaponin A","C42H66O14","C08984","11176"
"4-Nitroaniline","C6H6N2O2","C02126","5205"
"Remikiren","C33H50N4O6S","C07465","9668"
"Enalkiren","C35H56N6O6","C07466","9669"
"Chloraminophenamide","C6H8ClN3O4S2","C07460","9663"
"Chlorothiazide","C7H6ClN3O4S2","C07461","9664"
"Terfenadine","C32H41NO2","C07463","9666"
"Ketanserin","C22H22FN3O3","C07464","9667"
"Isosorbide dinitrate","C6H8N2O8","C07456","9659"
"Amyl nitrite","C5H11NO2","C07457","9660"
"Sulfanilamide","C6H8N2O2S","C07458","9661"
"Dichlorphenamide","C6H6Cl2N2O4S2","C07459","9662"
"Teicoplanin A2-1","C88H95Cl2N9O33","C13587","853949"
"Teicoplanin A2-3","C88H97Cl2N9O33","C13588","853950"
"Cyclopenthiazide","C13H18ClN3O4S2","C13568","853931"
"Chromomycin A3","C57H82O26","C13569","853932"
"4,5-Diphenylimidazole","C15H12N2","C13574","853937"
"Gemeprost","C23H38O5","C13581","853943"
"Alprostadil alfadex","C56H94O35","C13548","853913"
"24-Hydroxycholesterol","C27H46O2","C13550","7846926"
"Clinprost","C22H36O4","C13552","853916"
"Prednisolone 21-all-cis-farnesylate","C36H50O6","C13554","586237"
"Zwittergent 3-14","C19H41NO3S","C11216","13396"
"p-Fluorophenylalanine","C9H10FNO2","C11217","13397"
"Yiamoloside B","C43H68O15","C08990","11182"
"Rovrol","C13H13Cl2N3O3","C11208","13389"
"Cefoselis","C19H22N8O6S2","C11210","13390"
"p-Methylaminophenol sulfate","C14H20N2O6S","C11206","13387"
"Fenapanil","C16H19N3","C11207","13388"
"SDZ PSC 833","C63H111N11O12","C11213","13393"
"Thiocarbohydrazide","CH6N4S","C11214","13394"
"Cefluprenam","C20H25FN8O6S2","C11211","13391"
"NIK250","C26H27N3O4S2","C11212","13392"
"Procainamide","C13H21N3O","C07401","9605"
"Procarbazine","C12H19N3O","C07402","9606"
"Quinapril","C25H30N2O5","C07398","9602"
"Pralidoxime","C7H9N2O+","C07400","9604"
"Propiomazine","C20H24N2OS","C07405","9609"
"Propoxyphene","C22H29NO2","C07406","9610"
"Prochlorperazine","C20H24ClN3S","C07403","9607"
"Promethazine","C17H20N2S","C07404","9608"
"Propranolol","C16H21NO2","C07407","9611"
"Protriptyline","C19H21N","C07408","9612"
"2-Carboxy-2-hydroxy-8-carboxychromene","C11H8O6","C14094","854330"
"2-Hydroxy-3-carboxybenzalpyruvate","C11H8O6","C14095","854331"
"cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene","C11H10O4","C14092","854328"
"1,2-Dihydroxy-8-carboxynaphthalene","C11H8O4","C14093","854329"
"1-Naphthaldehyde","C11H8O","C14090","854326"
"1-Naphthoic acid","C11H8O2","C14091","854327"
"3-Methylsalicylate","C8H8O3","C14088","854324"
"1-Hydroxymethylnaphthalene","C11H10O","C14089","854325"
"2-Hydroxy-3-methylbenzalpyruvate","C11H10O4","C14086","854322"
"3-Methylsalicylaldehyde","C8H8O2","C14087","854323"
"Leukotriene D4","C25H40N2O6S","C05951","8235"
"2-Methylpropanamine","C4H11N","C02787","5738"
"trans-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA","C31H50N7O17P3S","C11945","14106"
"cis-2-Methyl-5-isopropylhexa-2,5-dienoic acid","C10H16O2","C11944","14105"
"Myrtenal","C10H14O","C11939","14100"
"Myrtenol","C10H16O","C11938","14099"
"(1S,4R)-1-Hydroxy-2-oxolimonene","C10H16O2","C11937","14098"
"3-Isopropenylpimelyl-CoA","C31H50N7O19P3S","C11936","14097"
"trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid","C10H16O2","C11943","14104"
"trans-2-Methyl-5-isopropylhexa-2,5-dienal","C10H16O","C11942","14103"
"Pinocarveol","C10H16O","C11941","14102"
"Myrtenic acid","C10H14O2","C11940","14101"
"Sapropterin","C9H15N5O3","","184489"
"Propionylglycine","C5H9NO3","","435803"
"Pentonic acid","C5H10O6","",""
"N-Acetyl-a-neuraminic acid","C11H19NO9","",""
"N-Acetyl-8-O-methyl-Neuraminic acid","C12H21NO9","",""
"N-Acetyl-9-O-lactoylneuraminic acid","C14H23NO11","","769622"
"Octadecanedioic acid","C18H34O4","","70095"
"N-Acetylgalactosamine 4-sulphate","C8H15NO9S","",""
"N-Acrylylglycine methyl ester","C6H9NO3","",""
"N-Acetylglycine methyl ester","C5H9NO3","","249210"
"14-Dihydroxycornestin","C16H20O6","C08483","10676"
"Cucurbic acid","C12H20O3","C08482","10675"
"Simetride","C28H38N2O6","C13460","586199"
"Coronarian","C12H18N2O12","C08474","10667"
"Cibarian","C12H18N2O12","C08473","10666"
"Chelidonic acid","C7H4O6","C08476","10669"
"Cucumopine","C11H13N3O6","C08475","10668"
"Dianthramine","C14H11NO6","C08478","10671"
"Dianthalexin","C14H9NO3","C08477","10670"
"Indican","C14H17NO6","C08481","10674"
"6-Hydroxykynurenic acid","C10H7NO4","C08480","10673"
"2-methyl-6-phytyl-1,4-benzoquinone","C27H46O2","",""
"12-oxo-cis-9-dodecenoate","C12H20O3","",""
"18-oxooleate","C18H32O3","",""
"3,4-dihydroxy-2-butanone-4-P","C4H9O6P","","702192"
"3-methylthiopropyl-desulfo-glucosinolate","C11H21NO6S2","",""
"benzyl-desulfoglucosinolate","C14H19NO6S","",""
"phospho-hydroxy-threonine","C4H9NO7P-","",""
"episterol","C28H46O","","3727349"
"indole-3-acetyl-asp","C14H14N2O5","","3883186"
"beta-Lactose","C12H22O11","C01970","5071"
"beta-Maltose","C12H22O11","C01971","5072"
"Undecaprenol","C55H90O","C01968","5069"
"Xanthommatin","C20H13N3O8","C01969","5070"
"(S)-Mandelate","C8H8O3","C01984","5081"
"11-Oxosteroid","C19H30O2","C01985","5082"
"(R)-Amygdalin","C20H27NO11","C01982","5079"
"Cyanidin 3-O-(6''-glucosyl-2''-xylosylgalactoside)","C32H39O20+","C08612","10805"
"Rubixanthin","C40H56O","C08611","10804"
"Rhodoxanthin","C40H50O2","C08610","10803"
"Physalien","C72H116O4","C08609","10802"
"Norbixin","C24H28O4","C08608","10801"
"Neurosporaxanthin","C40H52O2","C08607","10800"
"Neoxanthin","C40H56O4","C08606","10799"
"Mutatochrome","C40H56O","C08605","10798"
"Cyanidin 3-O-glucoside","C21H21O11+","C08604","10797"
"(R)-Mandelate","C8H8O3","C01983","5080"
"Tiludronic acid","C7H9ClO6P2S","C08141","10341"
"Frullanolide","C15H20O2","C09454","11645"
"Gaillardin","C17H22O5","C09455","11646"
"Farinosin","C15H18O4","C09450","11641"
"Fastigilin B","C20H26O6","C09451","11642"
"Fastigilin C","C20H24O6","C09452","11643"
"Florilenalin","C15H20O4","C09453","11644"
"Glaucine","C21H25NO4","C09446","11637"
"10-epi-Eupatoroxin","C20H24O8","C09447","11638"
"Eupatundin","C20H24O7","C09448","11639"
"Euponin","C20H24O6","C09449","11640"
"Acrophylline","C17H17NO3","C10634","12817"
"Justicidin A","C22H18O7","C10633","12816"
"Mulberrofuran C","C34H28O9","C08928","11120"
"Acronidine","C18H17NO4","C10629","12812"
"Acronycine","C20H19NO3","C10632","12815"
"Acronycidine","C15H15NO5","C10631","12814"
"Zinnimidine","C15H19NO3","C10626","12809"
"Withasomnine","C12H12N2","C10625","12808"
"cis-Hinokiresinol","C17H16O2","C10628","12811"
"Hinokinin","C20H18O6","C10627","12810"
"Pisiferic acid","C20H28O3","C09163","11355"
"Ergocornine","C31H39N5O5","C09162","11354"
"2-Oxohept-3-enedioate","C7H8O5","C03063","5963"
"3-Dehydro-L-threonate","C4H6O5","C03064","5964"
"Phorbol 12-tiglate 13-decanoate","C35H52O8","C09157","11349"
"Epivoacorine","C43H52N4O6","C09156","11348"
"Phorbol","C20H28O6","C09155","11347"
"Ellipticine","C17H14N2","C09154","11346"
"Pimelea factor P2","C37H50O9","C09161","11353"
"Ergine","C16H17N3O","C09160","11352"
"17beta-Hydroxysteroid","C19H32O2","C03051","5954"
"2,3-Dihydrogossypetin","C15H12O8","C03052","5955"
"(+/-)-6-Hydroxy-3-oxo-alpha-ionone","C13H18O3","C04223","6895"
"trans-5-O-(4-Coumaroyl)-D-quinate","C16H18O8","C04222","6894"
"1,4,5,6-Tetrahydro-6-oxonicotinate","C6H7NO3","C04226","6897"
"(Z)-But-2-ene-1,2,3-tricarboxylate","C7H8O6","C04225","6896"
"alpha,alpha'-Trehalose 6-mycolate","C44H82O13","C04218","6891"
"all-trans-Pentaprenyl diphosphate","C25H44O7P2","C04217","6890"
"trans-1,2-Dihydrobenzene-1,2-diol","C6H8O2","C04221","6893"
"alpha-D-Aldosyl beta-D-fructoside","C12H22O11","C04219","6892"
"1-(Indol-3-yl)propanol 3-phosphate","C11H14NO4P","C04229","6899"
"1-(4-Hydroxyphenyl)-2-aminoethanol","C8H11NO2","C04227","6898"
"Funtumine","C21H35NO","C10806","12989"
"Leiocarposide","C27H34O16","C10805","12988"
"Cyanuric acid","C3H3N3O3","C06554","8783"
"Biuret","C2H5N3O2","C06555","8784"
"Hydroxyatrazine","C8H15N5O","C06552","8781"
"N-Isopropylammelide","C6H10N4O2","C06553","8782"
"Piperonal","C8H6O3","C10812","12995"
"Atrazine","C8H14ClN5","C06551","8780"
"Paravallarine","C22H33NO2","C10814","12997"
"Kurchessine","C25H44N2","C10813","12996"
"2,4-Dihydroxy-6-(N'-ethyl)amino-1,3,5-triazine","C5H8N4O2","C06558","8787"
"Deethylatrazine","C6H10ClN5","C06559","8788"
"epi-Tulipinolide","C17H22O4","C09566","11757"
"Isodiospyrin","C22H14O6","C10358","12544"
"Longifolonine","C17H15NO4","C09569","11760"
"Bayogenin 3-O-cellobioside","C42H68O15","C08932","11124"
"Petasitenine","C19H27NO7","C10359","12545"
"2-C-Methyl-D-erythritol 4-phosphate","C5H13O7P","C11434","13606"
"4-(Cytidine 5'-diphospho)-2-C-methyl-D-erythritol","C14H25N3O14P2","C11435","13607"
"2-Phospho-4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol","C14H26N3O17P3","C11436","13608"
"1-Deoxy-D-xylulose 5-phosphate","C5H11O7P","C11437","13609"
"C-1027 Chromophore","C43H42ClN3O13","C11438","13610"
"Deshydroxy-C-1027 chromophore","C43H42ClN3O12","C11441","13613"
"Aromatized C-1027 chromophore","C43H44ClN3O13","C11442","13614"
"Aromatized deshydroxy-C-1027 chromophore","C43H44ClN3O12","C11443","13615"
"4-(1,2-Epoxyethyl)-8,9-epoxy-enediyne","C14H8O2","C11445","13617"
"4-Dihydroxyethyl-8,9-epoxy-enediyne","C14H10O3","C11446","13618"
"Camellidin I","C55H86O25","C08933","11125"
"Samidin","C21H22O7","C09310","11501"
"Silychristin","C25H22O10","C08717","10910"
"Otonecine","C9H15NO3","C10356","12542"
"Cytisine","C11H14N2O","C10763","12946"
"5,6-Dehydrolupanine","C15H22N2O","C10764","12947"
"Thalicsessine","C22H27NO4","C08714","10907"
"Nogalonic acid","C20H14O8","C12416","582806"
"Syringetin","C17H14O8","C11620","13785"
"Calpurnine","C20H27N3O3","C10757","12940"
"Tetramethylrosamine","C24H24ClN2O+","C11622","13787"
"Vinblastine sulfate","C46H60N4O13S","C11626","13791"
"Pristinamycin IB","C44H52N8O10","C11616","13781"
"Pristinamycin IC","C44H52N8O10","C11617","13782"
"Puromycin dihydrochloride","C22H31Cl2N7O5","C11618","13783"
"Spectinomycin dihydrochloride","C14H26Cl2N2O7","C11619","13784"
"p-Aminobenzamidine dihydrochloride","C7H11Cl2N3","C11628","13793"
"Deacetoxycephalosporin C","C14H19N3O6S","C06565","8794"
"Amlodipine","C20H25ClN2O5","C06825","9043"
"alpha-L-Arabinose","C5H10O5","C02604","5591"
"Astemizole","C28H31FN4O","C06832","9050"
"Anthralin","C14H10O3","C06831","9049"
"Anisotropine methylbromide","C17H32BrNO2","C06830","9048"
"Caulophylline","C12H16N2O","C10760","12943"
"Ipomoeamarone","C15H22O3","C09689","11879"
"4-(FLUOROPHENYL)-1-CYCLOPROPYLMETHYL-5-(2-AMINO-4-PYRIMIDINYL)IMIDAZOLE","C17H16FN5","C14316","7890384"
"Benz[a]anthracene","C18H12","C14317","148782"
"4',6,7-Trihydroxyisoflavone","C15H10O5","C14314",""
"Anthracene","C14H10","C14315","151568"
"Propazine","C9H16ClN5","C14312","151916"
"3',4',7-Trihydroxyisoflavone","C15H10O5","C14313","3881497"
"Picloram","C6H3Cl3N2O2","C14310","159245"
"4-Propylphenol","C9H12O","C14311","155908"
"5-Chloro-1,2,4-trihydroxybenzene","C6H5ClO3","C07102","9313"
"2,4,5-Trichlorophenol","C6H3Cl3O","C07101","9312"
"Loxapine","C18H18ClN3O","C07104","9315"
"2-Hydroxy-1,4-benzoquinone","C6H4O3","C07103","9314"
"2,4,6-Trichlorophenol","C6H3Cl3O","C07098","9309"
"2,6-Dichlorohydroquinone","C6H4Cl2O2","C07097","9308"
"2,4,5-Trichlorophenoxyacetic acid","C8H5Cl3O3","C07100","9311"
"SR 141716","C22H21Cl3N4O","C14319","789414"
"Dihydrokalafungin","C16H14O6","C12436","582826"
"Geniposide pentaacetate","C27H34O15","C11639","13804"
"alpha-Irone","C14H22O","C09690","11880"
"3-Amino-2-oxopropyl phosphate","C3H8NO5P","C11638","13803"
"(-)-Sympatol","C9H13NO2","C01869","4983"
"(R)-2-Methylmalate","C5H8O5","C02612","5597"
"(R)-Vicianin","C19H25NO10","C01870","4984"
"1,4-Dithiane","C4H8S2","C01871","4985"
"13-Dihydrocarminomycin","C26H29NO10","C12431","582821"
"D-Mannosylglycoprotein","C34H57N5O23","C03268","6131"
"13-Dihydrodaunorubicin","C27H31NO10","C12430","582820"
"Illudin M","C15H20O3","C09687","11877"
"13-Deoxydaunorubicin","C27H31NO9","C12429","582819"
"L-2,4-Diaminobutanoate","C4H10N2O2","C03283","6142"
"(S)-2-Methylmalate","C5H8O5","C02614","5599"
"13-Deoxycarminomycin","C26H29NO9","C12428","582818"
"Umbelliferone","C9H6O3","C09315","11506"
"5-Deoxodihydrokalafungin","C16H16O5","C12435","582825"
"Trioxsalen","C14H12O3","C09314","11505"
"(S)-DNPA","C16H14O5","C12434","582824"
"Indicaxanthin","C14H16N2O6","C08549","10742"
"Scorpioidin","C16H20O4","C09548","11739"
"(13S)-13-Dihydrodaunorubicin","C27H31NO10","C12433","582823"
"Seselin","C14H12O3","C09312","11503"
"Carminomycin","C26H27NO10","C12432","582822"
"Scoparone","C11H10O4","C09311","11502"
"Taurolithocholate","C26H45NO5S","C02592","5584"
"Lemildipine","C20H22Cl2N2O6","C12551","582941"
"Methyprylon","C10H17NO2","C12550","582940"
"Oxabolone cipionate","C26H38O4","C12549","582939"
"Nadifloxacin","C19H21FN2O4","C12547","582937"
"Iguratimod","C17H14N2O6S","C12546","582936"
"Azelnidipine","C33H34N4O6","C12544","582934"
"Prulifloxacin","C21H20FN3O6S","C12543","582933"
"Sulfadimethoxine","C12H14N4O4S","C12541","582931"
"Rutarin","C20H24O10","C09309","11500"
"Pazufloxacin","C16H15FN2O4","C12553","582943"
"Oxethazaine","C28H41N3O3","C12552","582942"
"Saupirin","C19H22O6","C09547","11738"
"(R)-Propane-1,2-diol","C3H8O2","C02912","5836"
"Psoralen","C11H6O3","C09305","11496"
"Tetradecanoyl-CoA","C35H62N7O17P3S","C02593","5585"
"Chrysophanic acid 9-anthrone","C15H12O3","C10314","12500"
"Chrysophanol","C15H10O4","C10315","12501"
"Chrysazin","C14H8O4","C10312","12498"
"Isococculidine","C18H23NO2","C09546","11737"
"Chryso-obtusin glucoside","C25H28O12","C10313","12499"
"Conocurvone","C60H56O11","C10318","12504"
"Thien-2-ylacetate","C6H6O2S","C02595","5586"
"Heliosupine","C20H31NO7","C10319","12505"
"Chrysophanol 8-O-beta-D-glucoside","C21H20O9","C10316","12502"
"Primidolol","C17H23N3O4","C11774","13938"
"2,3-Dihydroxy-3-methylpentanoate","C6H12O4","C04104","6795"
"Jatrorrhizine","C20H20NO4+","C09553","11744"
"Undecanoic acid","C11H22O2","","17735"
"Tricosanamide","C41H81NO3","",""
"Phenylacetyl-CoA","C29H42N7O17P3S","C00582","3861"
"Propane-1,2-diol","C3H8O2","C00583","3862"
"Dimethyl sulfide","C2H6S","C00580","3859"
"Guanidinoacetate","C3H7N3O2","C00581","3860"
"D-Glyceraldehyde","C3H6O3","C00577","3856"
"Dihydrolipoamide","C8H17NOS2","C00579","3858"
"Usambarine","C30H34N4","C09250","11441"
"Cholesteryl","C27H45","",""
"Taurallocholic acid","C26H45NO7S","",""
"Valerylglycine","C7H13NO3","",""
"Tauro-b-muricholic acid","C26H45NO7S","","745889"
"Cornudentanone","C22H34O5","C10320","12506"
"Estrololactone","C18H22O3","C14496","3885042"
"6beta-Hydroxytestosterone","C19H28O3","C14497","207550"
"Gypsogenin","C30H46O4","C08950","11142"
"psi-Rhodomyrtoxin","C24H28O7","C08951","11143"
"beta-Pyrufuran","C15H14O5","C08948","11140"
"Gypenoside XXV","C47H78O18","C08949","11141"
"Ginsenoside Rg1","C42H72O14","C08946","11138"
"Gymnemic acid I","C43H66O14","C08947","11139"
"Ginsenoside Re","C48H82O18","C08944","11136"
"Ginsenoside Rf","C42H72O14","C08945","11137"
"Luteolinidin","C15H11O5+","C08652","10845"
"Malonylawobanin","C39H39O22+","C08653","10846"
"Gypsogenin 3-O-rhamnosylglucuronide","C42H64O14","C08952","11144"
"Hederagenin 3-O-arabinoside","C35H56O8","C08953","11145"
"alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine","C25H42N2O19","C04886","7438"
"8-Benzyl-2-(4-hydroxybenzyl)-6-(4-hydroxyphenyl)imidazo-[1,2a]pyrazin-3(7H)-one","C25H22N4O3","C04888","7440"
"Usambarensine","C29H28N4","C09249","11440"
"(7E,9E,11Z,14Z)-(5S,6R)-6-(Cystein-S-yl)-5-hydroxyeicosa-7,9,11,14-tetraenoate","C23H37NO5S","C04879","7431"
"N-Acetyl-beta-D-mannosaminyl-1,4-N-acetyl-D-glucosaminyldiphosphoundecaprenol","C71H118N2O17P2","C04881","7433"
"UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine","C41H65N9O28P2","C04882","7434"
"(+/-)-5-[(tert-Butylamino)-2'-hydroxypropoxy]-3,4-dihydro-1(2H)-naphthalenone","C17H25NO3","C04883","7435"
"(+/-)-5-[(tert-Butylamino)-2'-hydroxypropoxy]-1,2,3,4-tetrahydro-1-naphthol","C17H27NO3","C04875","7427"
"N-Acetyl-D-glucosaminyl-N-acetylmuramoyl-L-Ala-D-glutamyl-6-carboxy-L-lysine","C33H54N6O20","C04876","7428"
"UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimelate","C35H55N7O26P2","C04877","7429"
"alpha-D-Galactosyl-1,3-D-galactosylbeta-1,4-N-acetyglucosaminyl-glycopeptide","C48H84N8O27","C04878","7430"
"Ferrocytochrome b1","C36H36FeN4O2","C00998","4244"
"Formylmethanofuran","C35H44N4O16","C01001","4247"
"4-Hydroxybutanoic acid","C4H8O3","C00989","4235"
"5-Aminopentanamide","C5H12N2O","C00990","4236"
"1,3-Diaminopropane","C3H10N2","C00986","4233"
"2-Phosphoglycolate","C2H5O6P","C00988","4234"
"D-Prephenyllactate","C13H14O8","C00994","4240"
"Ferricytochrome b1","C36H36FeN4O2+","C00995","4241"
"Aquacob(III)alamin","C62H91CoN13O15P+2","C00992","4238"
"D-Alanyl-D-alanine","C6H12N2O3","C00993","4239"
"Warfarin","C19H16O4","C01541","4702"
"Isothebaine","C19H21NO3","C09550","11741"
"Vincamine","C21H26N2O3","C09251","11442"
"Integerressine","C33H38N4O4","C10006","12192"
"o-Cresol","C7H8O","C01542","4703"
"Toxiferine I","C40H46N4O2+2","C09246","11437"
"2',3,4',6'-Tetrachloro-4-biphenylol","C12H6Cl4O","C14380","841816"
"3-O-Mycarosylerythronolide B","C28H50O10","C06630","8856"
"4-Hydroxy-2,3,3',4',5-pentachlorobiphenyl","C12H5Cl5O","C14381","755177"
"4-Hydroxy-2,2',3,4',5,5',6-heptachlorobiphenyl","C12H3Cl7O","C14382","755233"
"Nicotyrine","C10H10N2","C10161","12347"
"Myosmine","C9H10N2","C10160","12346"
"16-Ketoestradiol","C18H22O3","C14383","208501"
"Isolobinine","C18H25NO2","C10153","12339"
"(-)-Hygroline","C8H17NO","C10152","12338"
"Lentiginosine","C8H15NO2","C10155","12341"
"Juliflorine","C40H75N3O2","C10154","12340"
"Lobelanine","C22H25NO2","C10157","12343"
"Lobelanidine","C22H29NO2","C10156","12342"
"(+)-N-Methylconiine","C9H19N","C10159","12345"
"Mearsine","C9H13NO","C10158","12344"
"3-Ethylphenol","C8H10O","C14386","155415"
"Phenothrin","C23H26O3","C14387","175137"
"2,6-Dimethylaniline","C8H11N","C11004","13187"
"Isoproturon","C12H18N2O","C11005","13188"
"Isoflavone","C15H10O2","C00799","4057"
"2,6-Dichloro-4-nitroaniline","C6H4Cl2N2O2","C11000","13183"
"2,6-Diethylaniline","C10H15N","C11001","13184"
"Isofenphos","C15H24NO4PS","C11002","13185"
"2,4-Dimethylaniline","C8H11N","C11003","13186"
"Daminozide","C6H12N2O3","C10996","13179"
"Guazatine","C18H41N7","C10997","13180"
"4-Aminobiphenyl","C12H11N","C10998","13181"
"4,4'-Methylene-bis-(2-chloroaniline)","C13H12Cl2N2","C10999","13182"
"D-Lombricine","C6H15N4O6P","C01726","4863"
"Levanbiose","C12H22O11","C01725","4862"
"L-Fructose","C6H12O6","C01719","4856"
"Kynurenine","C10H12N2O3","C01718","4855"
"4-Hydroxy-2-quinolinecarboxylic acid","C10H7NO3","C01717","4854"
"Ketoprofen","C16H14O3","C01716","4853"
"Lanosterol","C30H50O","C01724","4861"
"L-Glucitol","C6H14O6","C01722","4859"
"L-Fuculose","C6H12O5","C01721","4858"
"L-Fuconate","C6H12O6","C01720","4857"
"S-Ribosyl-L-homocysteine","C9H17NO6S","C03539","6343"
"Thiopurine S-methylether","C6H6N4S","C03542","6346"
"Pyrimidine 5'-nucleotide","C9H15N2O7P","C03536","6341"
"S-Acetylthioethanolamine","C4H9NOS","C03537","6342"
"O-Acetylneuraminic acid","C11H19NO9","C03525","6333"
"O-Sinapoylglucarolactone","C17H20O10","C03526","6334"
"N-Methyl-4-aminobenzoate","C8H9NO2","C03522","6330"
"N2'-Acetylgentamicin C1a","C21H41N5O8","C03524","6332"
"N-Acetyl-L-phenylalanine","C11H13NO3","C03519","6328"
"N-Glycolyl-D-mannosamine","C8H15NO7","C03521","6329"
"Cannabidiol","C21H30O2","C07578","9781"
"Myricoside","C34H44O19","C10479","12662"
"Dioncophylline C","C23H25NO3","C12337","582727"
"Genistein 8-C-glucoside","C21H20O10","C10420","12606"
"Glabridin","C20H20O4","C10421","12607"
"alpha-Methylnoradrenaline","C9H13NO3","C11768","13932"
"Cyclohex-2-enone","C6H8O","C02395","5429"
"Uplandicine","C17H27NO7","C10412","12598"
"Usaramine","C18H25NO6","C10413","12599"
"Dalbergin","C16H12O4","C10414","12600"
"(+-)-Dalbergioidin","C15H12O6","C10415","12601"
"Dalpanin","C26H30O12","C10416","12602"
"Deguelin","C23H22O6","C10417","12603"
"(+-)-5-Deoxykievitone","C20H20O5","C10418","12604"
"Ferreirin","C16H14O6","C10419","12605"
"Phenobarbital","C12H12N2O3","C07434","9638"
"Phenoxybenzamine","C18H22ClNO","C07435","9639"
"Phenmetrazine","C11H15NO","C07432","9636"
"Phenmetrazine hydrochloride","C11H16ClNO","C07433","9637"
"Phenylbutazone","C19H20N2O2","C07440","9644"
"Phenylephrine","C9H13NO2","C07441","9645"
"Phensuximide","C11H11NO2","C07437","9641"
"Phentermine","C10H15N","C07438","9642"
"Phenytoin","C15H12N2O2","C07443","9647"
"Pindolol","C14H20N2O2","C07445","9648"
"1,2-Bis(4-hydroxyphenyl)-2-propanol","C15H16O3","C13629","586246"
"7-Ethoxyresorufin","C14H11NO3","C13630","7846927"
"5-Hydroxybisphenol","C15H16O3","C13626","586244"
"4,5-Bisphenol-o-quinone","C15H14O3","C13628","586245"
"2,2-Bis(4-hydroxyphenyl)-propanoic acid","C15H14O4","C13633","586249"
"2,3-Bis(4-hydroxyphenyl)-1,2-propanediol","C15H16O4","C13634","586250"
"2,2-Bis(4-hydroxyphenyl)-1-propanol","C15H16O3","C13631","586247"
"4,4'-Dihydroxy-alpha-methylstilbene","C15H14O2","C13632","586248"
"4-Hydroxyphenacyl alcohol","C8H8O3","C13635","586251"
"4-Hydroxyphenyl acetate","C8H8O3","C13636","586252"
"Ergosine","C30H37N5O5","C09167","11359"
"Epoxiconazole","C17H13ClFN3O","C11229","13408"
"Epirubicin","C27H29NO11","C11230","13409"
"Docetaxel anhydrous","C43H53NO14","C11231","13410"
"Diphenylcarbazide","C13H14N4O","C11232","13411"
"Dimethyl phthalate","C10H10O4","C11233","13412"
"Difloxacin","C21H19F2N3O3","C11234","13413"
"Diclobutrazol","C15H19Cl2N3O","C11235","13414"
"Niguldipine","C36H39N3O6","C11236","13415"
"17beta-Estradiol 17-(beta-D-glucuronide)","C24H31O8-","C11237","13416"
"GF 109203X","C25H24N4O2","C11238","13417"
"Aquayamycin","C25H26O10","C12412","582802"
"CGS 7181","C20H17F3N2O4","C13836","854081"
"4-Hydroxymethylcatechol","C7H8O3","C14110","854346"
"5,6,7,8-Tetrahydro-2-naphthoic acid","C11H12O2","C14111","854347"
"cis-2-Carboxycyclohexyl-acetic acid","C9H14O4","C14112","854348"
"Decahydro-2-naphthoic acid","C11H18O2","C14113","854349"
"2-Hydroxy-7-hydroxymethylchromene-2-carboxylate","C11H10O5","C14106","854342"
"2-Hydroxy-4-hydroxymethylbenzalpyruvate","C11H10O5","C14107","854343"
"4-Hydroxymethylsalicylaldehyde","C8H8O3","C14108","854344"
"4-Hydroxymethylsalicylate","C8H8O4","C14109","854345"
"Chalepensin","C16H14O3","C09165","11357"
"Tetralin","C10H12","C14114","854350"
"Naphthyl-2-methyl-succinic acid","C15H14O4","C14115","854351"
"Fudosteine","C6H13NO3S","C13317","586061"
"Gimeracil","C5H4ClNO2","C13318","586062"
"Methylisoeugenol","C11H14O2","C10478","12661"
"Anemone blue anthocyanin 3","C64H67O42+","C12132","14279"
"Anemone blue anthocyanin 2","C60H63O37+","C12131","14278"
"Isoformononetin","C16H12O4","C12125","14272"
"Apiforol","C15H14O5","C12124","14271"
"7,4'-Dihydroxyflavone","C15H10O4","C12123","14270"
"Luteoliflavan","C15H14O5","C12122","14269"
"Anemone blue anthocyanin 1","C57H61O34+","C12130","14277"
"Anemone purple anthocyanin 1","C64H67O41+","C12129","14276"
"(-)-Epiafzelechin","C15H14O5","C12128","14275"
"(+)-Gallocatechin","C15H14O7","C12127","14274"
"Celabenzine","C23H29N3O2","C10578","12761"
"Methyl caffeate","C10H10O4","C10477","12660"
"Brucine","C23H26N2O4","C09084","11276"
"D-Ribose","C5H10O5","C00121","3421"
"Biotin","C10H16N2O3S","C00120","3420"
"L-Leucine","C6H13NO2","C00123","3423"
"Fumarate","C4H4O4","C00122","3422"
"D-Ribose 5-phosphate","C5H11O8P","C00117","3417"
"Glycerol","C3H8O3","C00116","3416"
"5-Phospho-alpha-D-ribose 1-diphosphate","C5H13O14P3","C00119","3419"
"(2R)-2-Hydroxy-3-(phosphonooxy)-propanal","C3H7O6P","C00118","3418"
"Illudin S","C15H20O4","C09688","11878"
"Ferricytochrome c","C42H52FeN8O6S2+","C00125","3425"
"D-Galactose","C6H12O6","C00124","3424"
"Avermectin B2b monosaccharide","C40H60O12","C11957","14118"
"Avermectin A2b aglycone","C34H50O9","C11956","14117"
"Avermectin B2b","C47H72O15","C11959","14120"
"Avermectin A2b monosaccharide","C41H62O12","C11958","14119"
"6,8a-Seco-6,8a-deoxy-5-oxoavermectin ''1b'' aglycone","C33H46O7","C11961","14122"
"Avermectin A2b","C48H74O15","C11960","14121"
"Avermectin B1b aglycone","C33H46O8","C11963","14124"
"5-Oxoavermectin ''1b'' aglycone","C33H44O8","C11962","14123"
"Avermectin B1b monosaccharide","C40H58O11","C11965","14126"
"Avermectin A1b aglycone","C34H48O8","C11964","14125"
"2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine","C7H9N5O2","C01300","4518"
"1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol","C7H17N4O4+","C01298","4516"
"1-Guanidino-1-deoxy-scyllo-inositol 4-phosphate","C7H17N3O8P+","C01294","4513"
"3alpha,7alpha-Dihydroxy-12-oxo-5beta-cholanate","C24H38O5","C01292","4511"
"1-(6-Hydroxypyrid-3-yl)-4-(methylamino)butan-1-one","C10H14N2O2","C01297","4515"
"5D-5-O-Methyl-2,3,5/4,6-pentahydroxycyclohexanone","C7H12O6","C01295","4514"
"2-Dehydro-3-deoxy-D-galactonate 6-phosphate","C6H11O9P","C01286","4505"
"2,6-Dichlorophenol-4-(p-benzoquinone imine)","C16H11Cl2NO2","C01285","4504"
"3-(4-Methylpent-3-en-1-yl)-pent-2-enedioyl-CoA","C32H50N7O18P3S","C01291","4510"
"N-Acetyl-D-glucosaminyldiphosphoundecaprenol","C63H105NO12P2","C01289","4508"
"Glucoraphanin","C12H22NO10S3-","C08419","10615"
"Glucoputranjivin","C10H18NO9S2-","C08418","10614"
"Gluconasturtiin","C15H20NO9S2-","C08417","10613"
"Gluconapoleiferin","C12H20NO10S2-","C08416","10612"
"Gluconapin","C11H18NO9S2-","C08415","10611"
"Glucolimnanthin","C15H20NO10S2-","C08414","10610"
"Glucolepidiin","C9H16NO9S2-","C08413","10609"
"Glucoiberverin","C11H20NO9S3-","C08412","10608"
"Glucoiberin","C11H20NO10S3-","C08411","10607"
"Glucoerysolin","C12H22NO11S3-","C08410","10606"
"Xanthyletin","C14H12O3","C09317","11508"
"5D-5-O-Methyl-scyllo-inositol","C7H14O6","C05163","7579"
"Pittoside A","C41H68O13","C08969","11161"
"2'-Hydroxyisoflavone","C15H10O3","C02921","5844"
"erythronate-4-phosphate","C4H8O8P-","",""
"salicyloyl-CoA","C28H40N7O18P3S","",""
"ubiquinone(40)","C49H74O4","","738141"
"3-hydroxypropyl-glucosinolate","C10H19NO10S2","",""
"heme O","C49H58FeN4O5","",""
"UDP-3-O-(3-hydroxymyristoyl)glucosamine","C29H51N3O18P2","",""
"hydroxycinnamoyl-CoA","C30H44N7O18P3S","",""
"phenylacetaldoxime","C8H9NO","","677107"
"trans-zeatin riboside triphosphate","C15H24N5O14P3","",""
"isopentenyl-adenosine triphosphate","C15H24N5O13P3","",""
"2'-O-Methyllicodione","C16H14O5","C02922","5845"
"Juvabione","C16H26O3","C09693","11883"
"Urdamycin G","C37H46O14","C12414","582804"
"3-Carboxymethylmuconate","C8H8O6","C05592","7916"
"3-Hydroxyphenylacetate","C8H8O3","C05593","7917"
"3-Methoxy-4-hydroxyphenylethyleneglycol","C9H12O4","C05594","7918"
"4-Hydroxyphenylacetylglutamine","C13H15NO6","C05595","7919"
"2'-Hydroxyformononetin","C16H12O5","C02920","5843"
"Gentisate aldehyde","C7H6O3","C05585","7911"
"3-Methoxytyramine","C9H13NO2","C05587","7912"
"Gardenoside","C17H24O11","C09779","11967"
"Eupacunoxin","C22H28O8","C09429","11620"
"Geniposide","C17H24O10","C09781","11969"
"Gentiopicrin","C16H20O9","C09782","11970"
"Harpagoside","C24H30O11","C09783","11971"
"Ipolamiide","C17H26O11","C09784","11972"
"(+)-Iridodial","C10H16O2","C09785","11973"
"Iridomyrmecin","C10H16O2","C09786","11974"
"Isoplumericin","C15H14O6","C09787","11975"
"Monotropein","C16H22O11","C09788","11976"
"Euparotin","C20H24O7","C09434","11625"
"Euparotin acetate","C22H26O8","C09435","11626"
"Palustrine","C17H31N3O2","C10608","12791"
"Mycosporine","C11H19NO6","C10607","12790"
"Maytansine","C34H46ClN3O10","C10606","12789"
"Maculosin","C14H16N2O3","C10605","12788"
"Pleurostyline","C25H29N3O2","C10612","12795"
"Pithecolobine","C22H46N4O","C10611","12794"
"Pilosine","C16H18N2O3","C10610","12793"
"Phyllospadine","C21H21NO6","C10609","12792"
"Securinine","C13H15NO2","C10614","12797"
"Porritoxin","C17H23NO4","C10613","12796"
"Montanin","C32H48O8","C09135","11327"
"Mezerein","C38H38O10","C09134","11326"
"Uridine 2'-phosphate","C9H13N2O9P","C03031","5936"
"Montanin A","C19H20O4","C09136","11328"
"Coronaridine","C21H26N2O2","C09139","11331"
"Nagilactone C","C19H22O7","C09138","11330"
"Byakangelicin","C17H18O7","C09141","11333"
"Neocembrene","C20H32","C09140","11332"
"12-O-2Z,4E-Octadienoyl-4-deoxyphorbol 13-acetate","C30H40O7","C09143","11335"
"Cryptolepine","C16H12N2","C09142","11334"
"dTDP-D-galacturonate","C16H24N2O17P2","C03034","5939"
"gamma-Linolenoyl-CoA","C39H64N7O17P3S","C03035","5940"
"Thiopental","C11H18N2O2S","C07521","9724"
"1-Methylnicotinamide","C7H9N2O+","C02918","5841"
"4-Hydroxyhomopterocarpin","C17H16O5","C10461","12644"
"Isoflurane","C3H2ClF5O","C07518","9721"
"Methoxyflurane","C3H4Cl2F2O","C07517","9720"
"Gniditrin","C37H42O10","C09102","11294"
"Sevoflurane","C4H3F7O","C07520","9723"
"Grayanotoxin I","C22H36O7","C09103","11295"
"Aphylline","C15H24N2O","C10752","12935"
"Angustifoline","C14H22N2O","C10751","12934"
"Anagyrine","C15H20N2O","C10750","12933"
"Ammothamnine","C15H24N2O2","C10749","12932"
"Aloperine","C15H24N2","C10748","12931"
"Albine","C14H20N2O","C10747","12930"
"Juvenile hormone III","C16H26O3","C09694","11884"
"Veprisinium","C18H24NO5+","C10745","12928"
"Amphetamine","C9H13N","C07514","9717"
"Argyrolobine","C15H22N2O2","C10754","12937"
"Argentine","C23H26N4O3","C10753","12936"
"Canthin-6-one","C14H8N2O","C09098","11290"
"Enflurane","C3H2ClF5O","C07516","9719"
"Naringenin 7-O-beta-D-glucoside","C21H22O10","C09099","11291"
"Halothane","C2HBrClF3","C07515","9718"
"Caracurine V","C38H40N4O2","C09100","11292"
"Gnididilatin","C37H48O10","C09101","11293"
"Geranylgeraniol","C20H34O","C09094","11286"
"Gnidicin","C36H36O10","C09095","11287"
"Gnididin","C37H44O10","C09096","11288"
"Calycanthidine","C23H28N4","C09097","11289"
"(3S,6S)-6-Isopropenyl-3-methyl-2-oxo-oxepanone","C10H16O2","C11418","13592"
"(3S)-3-Isopropenyl-6-oxoheptanoate","C10H15O3-","C11419","13593"
"(1S,2R,4S)-Neo-dihydrocarveol","C10H18O","C11416","13590"
"(3S)-6-Hydroxy-3-isopropenyl-heptanoate","C10H17O3-","C11417","13591"
"(4S,7R)-4-Isopropenyl-7-methyl-2-oxo-oxepanone","C10H16O2","C11414","13588"
"(1S,4S)-Dihydrocarvone","C10H16O","C11415","13589"
"(1R,4S)-Iso-dihydrocarvone","C10H16O","C11412","13586"
"(1S,2S,4S)-Dihydrocarveol","C10H18O","C11413","13587"
"(S)-2-O-Sulfolactate","C3H6O6S","C02914","5837"
"(5S)-6-Hydroxy-5-isopropenyl-2-methylhexanoate","C10H17O3-","C11420","13594"
"(3S)-3-Isopropenyl-6-oxoheptanoyl-CoA","C31H50N7O18P3S","C11421","13595"
"4,4-Dimethyl-5alpha-cholest-7-en-3beta-ol","C29H50O","C04530","7140"
"Benazepril","C24H28N2O5","C06843","9061"
"Benzonatate","C30H53NO11","C06844","9062"
"cis-2,3-Dihydroxy-2,3-dihydro-p-cumate","C10H14O4","C06579","8808"
"2,3-Dihydroxy-p-cumate","C10H12O4","C06580","8809"
"Atovaquone","C22H19ClO3","C06835","9053"
"Auranofin","C20H34AuO9PS","C06836","9054"
"Azathioprine","C9H7N7O2S","C06837","9055"
"Azithromycin","C38H72N2O12","C06838","9056"
"Azlocillin","C20H23N5O6S","C06839","9057"
"Aztreonam","C13H17N5O8S2","C06840","9058"
"Baclofen","C10H12ClNO2","C06841","9059"
"Beclomethasone","C22H29ClO5","C06842","9060"
"Rhodomycin D","C28H31NO11","C12426","582816"
"10-Carboxy-13-deoxycarminomycin","C27H29NO11","C12427","582817"
"8-Epideoxyloganin","C17H26O9","C11648","13813"
"8-Epideoxyloganic acid","C16H24O9","C11649","13814"
"Dihydro-NAME","C21H18O8","C12418","582808"
"16-Hydroxytabersonine","C21H24N2O3","C11643","13808"
"12-Deoxyaklanonic acid","C21H18O7","C12420","582810"
"Aklanonic acid","C21H16O8","C12421","582811"
"Aklanonic acid methyl ester","C22H18O8","C12422","582812"
"Deoxyloganic acid tetraacetate","C24H32O13","C11647","13812"
"Aklavinone","C22H20O8","C12424","582814"
"epsilon-Rhodomycinone","C22H20O9","C12425","582815"
"2-Hydroxy-4-methoxybenzophenone","C14H12O3","C14285","151727"
"Isocaryophyllene","C15H24","C09691","11881"
"5-Nitrofurfural","C5H3NO4","C14281","156116"
"100-2","C31H36O12","C12408","582798"
"Furfural","C5H4O2","C14279","150426"
"N-Formiminoglycine","C3H6N2O2","C02718","5681"
"Menadiol","C11H10O2","C07126","9336"
"Tamsulosin","C20H28N2O5S","C07124","9334"
"2-Hydroxy-6-oxo-octa-2,4-dienoate","C8H10O4","C07123","9333"
"Megestrol","C22H30O3","C07120","9331"
"Theophylline","C7H8N4O2","C07130","9340"
"Terbutaline","C12H19NO3","C07129","9339"
"Meperidine","C15H21NO2","C07128","9338"
"Terazosin","C19H25N5O4","C07127","9337"
"Ticarcillin","C15H16N2O6S2","C07139","9348"
"Thiethylperazine","C22H29N3S2","C07132","9342"
"Cob(II)yrinate a,c diamide","C45H61CoN6O12+","C06504","8735"
"N-Acetylputrescine","C6H14N2O","C02714","5677"
"Cob(I)yrinate a,c diamide","C45H61CoN6O12+","C06505","8736"
"Fluoren-9-ol","C13H10O","C06711","8936"
"MC-7181","C14H8Cl2FNO5","C11070","13252"
"Mycothiol","C17H30N2O12S","C06717","8940"
"Fluoren-9-one","C13H8O","C06712","8937"
"Fusidic acid","C31H48O6","C06694","8919"
"Cefaloglycin","C18H19N3O6S","C13440","586181"
"Dexamethasone valerate","C27H37FO6","C13439","853864"
"5alpha-Androstan-3beta,17beta-diol","C19H32O2","C12525","582915"
"Calcipotriene","C27H40O3","C12523","582913"
"2-Oxazolidinone","C3H5NO2","C06695","8920"
"Meglumine sodium amidotrizoate","C29H34I6N5NaO13","C13429","586171"
"Pyrithione zinc","C10H8N2O2S2Zn","C13427","586169"
"I-123 BMIPP","C22H35IO2","C13426","586168"
"3-Hexaprenyl-4-hydroxybenzoate","C37H54O3","C13425","586167"
"Glyceryl monostearate","C21H42O4","C13438","586180"
"9-cis-Violaxanthin","C40H56O4","C13433","586175"
"Chlorobutanol","C4H7Cl3O","C13432","586174"
"Mizolastine","C24H25FN6O","C12514","582904"
"Monensin","C36H62O11","C06693","8918"
"Candicidin D","C59H84N2O18","C06690","8915"
"THTA","C6H10O2S","C11072","13254"
"Actinorhodine","C32H26O14","C06691","8916"
"Isovelleral","C15H20O2","C09692","11882"
"Bis(4-hydroxyphenyl)methane","C13H12O2","C14298","155426"
"Cyanazine","C9H13ClN6","C14299","172854"
"5-Nitro-2-furfuryl methyl ether","C6H7NO4","C14293","154776"
"Diphenolic acid","C17H18O4","C14294","209285"
"Droloxifene","C26H29NO2","C14296","199578"
"4,4'-Dihydroxybiphenyl","C12H10O2","C14297","150148"
"Dibenzo-18-crown-6","C20H24O6","C14289","169250"
"7-Hydroxyflavanone","C15H12O3","C14290","738349"
"Carbofuran","C12H15NO3","C14291","158601"
"Dichlorophen","C13H10Cl2O2","C14292","150386"
"Tigogenin","C27H44O3","C08914","11106"
"alpha,alpha'-Trehalose 6-phosphate","C12H23O14P","C00689","3958"
"2,4,6/3,5-Pentahydroxycyclohexanone","C6H10O6","C00691","3959"
"Tigonin","C56H92O27","C08915","11107"
"(S)-2-Methyl-3-oxopropanoyl-CoA","C25H40N7O19P3S","C00683","3952"
"2-Dehydro-3-deoxy-L-arabinonate","C5H8O5","C00684","3953"
"dTDP-4-dehydro-6-deoxy-alpha-D-glucose","C16H24N2O15P2","C00687","3956"
"dTDP-4-dehydro-6-deoxy-L-mannose","C16H24N2O15P2","C00688","3957"
"5alpha-Androstane-3,17-dione","C19H28O2","C00674","3943"
"Tokoronin","C32H52O9","C08916","11108"
"meso-2,6-Diaminoheptanedioate","C7H14N2O4","C00680","3949"
"2-Hydroxymuconate semialdehyde","C6H6O4","C00682","3951"
"5b-Androstane-3a,17b-diol","C19H32O2","","380081"
"3-Methylglutarylcarnitine","C13H23NO6","","704761"
"Capric acid triglyceride","C33H62O6","","339537"
"Trigonelloside C","C51H84O22","C08917","11109"
"5b-Cholestane-3a,7a,12a,24,25-pentol","C27H48O5","",""
"Alloisoleucine","C6H13NO2","","125479"
"2-Hydroxy-3-keto-5-methylthio-1-phosphopentene","C6H11O6PS","","1948"
"Cotinine","C10H12N2O","","35227"
"25-Azacholesterol","C26H45NO","","742379"
"Deoxyribose 5-phosphate","C5H11O7P","","2616"
"Cotinineglucuronide","C16H21N2O7+","","585013"
"2,3-Diketo-5-methylthio-1-phosphopentane","C6H11O6PS","","2517"
"Nicotine imine","C10H13N2+","","585022"
"Succinyllipoic acid","C12H21NO4S2","","2528"
"4-(3-Pyridyl)-butanoic acid","C9H11NO2","","584951"
"Nicotine isomethonium ion","C11H17N2+","","585020"
"1,2-Dihydroxydibenzothiophene","C12H8O2S","C06722","8945"
"Abrusoside A","C36H54O10","C08920","11112"
"Aescin","C55H86O24","C08921","11113"
"2,3,2',3'-Tetrakis(3-hydroxytetradecanoyl)-D-glucosaminyl-1,6-beta-D-glucosamine 1-phosphate","C68H129N2O20P","C04932","7476"
"Aridanin","C38H61NO8","C08922","11114"
"1,3-alpha-D-Mannosyl-(1,2-N-acetyl-alpha-D-glucosaminyl)-1,2-alpha-D-mannosyl-1,2-alpha-D-mannosyl-D-mannose","C32H55NO26","C04923","7469"
"Argatroban","C23H36N6O5S","C04931","7475"
"Heme-thiolate(P-450)","C40H41FeN4O6S","C05009","7492"
"His-Leu","C12H20N4O3","C05010","7493"
"Fructose 1-phosphate(pyranose)","C6H13O9P","C05001","7488"
"Arvensoside A","C48H78O18","C08923","11115"
"Hydroxytamoxifen","C26H29NO2","C05011","7494"
"L-Glutamate methylester","C6H11NO4","C05016","7495"
"3-Isopropylcatechol","C9H12O2","C01014","4259"
"4-Hydroxy-L-proline","C5H9NO3","C01015","4260"
"5-Hydroxytryptophan","C11H12N2O3","C01017","4262"
"6-Deoxy-D-galactose","C6H12O5","C01018","4263"
"6-Deoxy-L-galactose","C6H12O5","C01019","4264"
"6-Hydroxynicotinate","C6H5NO3","C01020","4265"
"Dihydrostreptomycin","C21H41N7O12","C01023","4268"
"Hydroxymethylbilane","C40H46N4O17","C01024","4269"
"N,N-Dimethylglycine","C4H9NO2","C01026","4271"
"N6-Hydroxy-L-lysine","C6H14N2O3","C01028","4272"
"Z-Gly-Pro-Leu-Gly-Pro","C28H39N5O8","C03183","6062"
"Atherospermidine","C18H11NO4","C09347","11538"
"Autumnolide","C15H20O5","C09346","11537"
"Baileyin","C15H20O4","C09349","11540"
"Backebergine","C11H11NO2","C09348","11539"
"Budlein A","C20H22O7","C09351","11542"
"Bakkenolide A","C15H22O2","C09350","11541"
"2-Phenylaminoadenosine","C16H18N6O4","","62658"
"Calaxin","C19H20O6","C09353","11544"
"Fluocinolone acetonide","C24H30F2O6","C13295","586039"
"Ubiquinol","C49H78O4","","3244"
"(+)-Bebeerine","C36H38N2O6","C09352","11543"
"5a-Cholesta-8,24-dien-3-one","C27H42O","","853834"
"Papyriferic acid","C35H56O8","C08632","10825"
"Coprosterol","C27H48O","","254722"
"Quillaic acid","C30H46O5","C08972","11164"
"Rotundioside B","C54H87O26S-","C08973","11165"
"Canin","C15H18O5","C09354","11545"
"Phytolaccoside B","C36H56O11","C08968","11160"
"7-Methylguanosine","C11H16N5O5","","3735343"
"Primulasaponin","C54H90O22","C08970","11162"
"Propapyriogenin A2","C30H44O5","C08971","11163"
"Oleanoic acid 3-O-glucuronide","C36H56O9","C08964","11156"
"Pfaffic acid","C29H44O3","C08965","11157"
"Pfaffoside A","C40H60O13","C08966","11158"
"Phaseoloside D","C65H104O31","C08967","11159"
"3-Iodo-4-hydroxyphenylpyruvate","C9H7IO4","C03987","6703"
"3F-alpha-D-Galactosylraffinose","C24H42O21","C03989","6704"
"3alpha-Hydroxy-5beta-cholanate","C24H40O3","C03990","6705"
"4-(beta-D-Glucosyloxy)benzoate","C13H16O8","C03993","6706"
"4-Hydroxymethylphenylhydrazine","C7H10N2O","C03994","6707"
"Deoxypyridinoline","C18H29N4O7","",""
"Schaftoside","C26H28O14","C10181","12367"
"Santin","C18H16O7","C10180","12366"
"Robustaflavone","C30H18O10","C10179","12365"
"Robinin","C33H40O19","C10178","12364"
"Robinetin","C15H10O7","C10177","12363"
"Galactonic acid","C6H12O7","","705456"
"Quercetin 3-(2G-xylosylrutinoside)","C32H38O20","C10175","12361"
"Trichostachine","C16H17NO3","C10174","12360"
"Swainsonine","C8H15NO3","C10173","12359"
"Stachydrine","C7H13NO2","C10172","12358"
"Triazolidinedithione","C12H12BrN3S2","C10978","13161"
"Chlozolinate","C13H11Cl2NO5","C10979","13162"
"1-Oxa-2-oxo-3-methylcycloheptane","C7H12O2","C10976","13159"
"Thiadiazolidinethione","C12H12BrN3S2","C10977","13160"
"Cyfluthrin","C22H18Cl2FNO3","C10982","13165"
"dTDP-4-acetamido-4,6-dideoxy-D-glucose","C18H29N3O15P2","C06018","8290"
"Bifenthrin","C23H22ClF3O2","C10980","13163"
"Vinclozolin","C12H9Cl2NO3","C10981","13164"
"Cypermethrin","C22H19Cl2NO3","C10984","13167"
"Deltamethrin","C22H19Br2NO3","C10985","13168"
"Phloretate","C9H10O3","C01744","4878"
"Paromamine","C12H25N3O7","C01743","4877"
"Piperidine","C5H11N","C01746","4880"
"Pinosylvin","C14H12O2","C01745","4879"
"Pyocyanine","C13H12N2O","C01748","4882"
"Psychosine","C24H47NO7","C01747","4881"
"Resorcinol","C6H6O2","C01751","4884"
"Quercitrin","C21H20O11","C01750","4883"
"Sitosterol","C29H50O","C01753","4886"
"Scopoletin","C10H8O4","C01752","4885"
"trans-4-Hydroxy-D-proline","C5H9NO3","C03651","6431"
"(2R,3S)-2,3-Dimethylmalate","C6H10O5","C03652","6432"
"(3S,4R)-Ketose 1-phosphate","C6H13O9P","C03654","6433"
"(S)-5-Amino-3-oxohexanoic acid","C6H11NO3","C03656","6434"
"(13E)-11alpha-Hydroxy-9,15-dioxoprost-13-enoate","C20H32O5","C04654","7240"
"(2S,3S)-2-Hydroxytridecane-1,2,3-tricarboxylate","C16H28O7","C04655","7241"
"cis,trans-Hexadienedioate","C6H6O4","C03647","6428"
"cis-3,4-Leucopelargonidin","C15H14O6","C03648","6429"
"1,4-Dihydroxy-2-naphthoate","C11H8O4","C03657","6435"
"1-O-Methyl-myo-inositol","C7H14O6","C03659","6437"
"D-erythro-1-(Imidazol-4-yl)glycerol 3-phosphate","C6H11N2O6P","C04666","7249"
"(1S,4S)-4-Hydroxy-3-oxocyclohexane-1-carboxylate","C7H10O4","C04670","7251"
"Vigabatrin","C6H11NO2","C07500","9703"
"5-Fluorodeoxyuridine","C9H11FN2O5","C11736","13901"
"Benzenamine sulfate","C6H6NO3S-","C06011","8283"
"(S)-2-Acetolactate","C5H8O4","C06010","8282"
"Fumagillin","C26H34O7","C09668","11858"
"Trilobine","C35H34N2O5","C09669","11859"
"Quinolin-4-ol","C9H7NO","C06343","8579"
"Quinolin-2,8-diol","C9H7NO2","C06342","8578"
"7-alpha,27-Dihydroxycholesterol","C27H46O3","C06341","8577"
"27-Hydroxycholesterol","C27H46O2","C06340","8576"
"2,5,6-Trihydroxy-5,6-dihydroquinoline","C9H9NO3","C06339","8575"
"Quinolin-2-ol","C9H7NO","C06338","8574"
"Terephthalate","C8H6O4","C06337","8573"
"3-Sulfocatechol","C6H6O5S","C06336","8572"
"Xylopine","C18H17NO3","C09670","11860"
"3-Methyl-quinolin-2-ol","C10H9NO","C06345","8581"
"3-Methyl-quinolin-2,8-diol","C10H9NO2","C06344","8580"
"Beclomethasone dipropionate","C28H37ClO7","C07813","10015"
"Homatropine","C16H21NO3","C07814","10016"
"Formoterol","C19H24N2O4","C07805","10007"
"Pirbuterol","C12H20N2O3","C07807","10009"
"Flavoxate","C24H25NO4","C07809","10011"
"Hexocyclium","C20H34N2O5S","C07811","10013"
"Olopatadine","C21H23NO3","C07789","9991"
"Phenindamine","C19H19N","C07790","9992"
"Naratriptan","C17H25N3O2S","C07792","9994"
"Dihydroergotamine","C33H37N5O5","C07798","10000"
"(S)-Norlaudanosoline","C16H17NO4","C02916","5839"
"DL-2-Aminooctanoic acid","C8H17NO2","","42235"
"Retinoate","C20H28O2","C00777","4038"
"5-Methylcytidine","C10H15N3O5","","669849"
"D-Apiitol","C5H12O4","C01569","4726"
"Scytalone","C10H10O4","C00779","4040"
"Chlorpheniramine","C16H19ClN2","C06905","9122"
"Chlorpromazine","C17H19ClN2S","C06906","9123"
"Cephapirin","C17H17N3O6S2","C06896","9113"
"Cephradine","C16H19N3O4S","C06897","9114"
"Chloral hydrate","C2H3Cl3O2","C06899","9116"
"Chlorambucil","C14H19Cl2NO2","C06900","9117"
"Chlordiazepoxide","C16H14ClN3O","C06901","9118"
"Chlorhexidine","C22H30Cl2N10","C06902","9119"
"Chlormezanone","C11H12ClNO3S","C06903","9120"
"Chlorotrianisene","C23H21ClO3","C06904","9121"
"Avermectin B1a","C48H72O14","C11983","14144"
"Avermectin A1a monosaccharide","C42H62O11","C11982","14143"
"Avermectin B1a monosaccharide","C41H60O11","C11981","14142"
"Avermectin A1a aglycone","C35H50O8","C11980","14141"
"Avermectin B1a aglycone","C34H48O8","C11979","14140"
"5-Oxoavermectin ''1a'' aglycone","C34H46O8","C11978","14139"
"6,8a-Seco-6,8a-deoxy-5-oxoavermectin ''1a'' aglycone","C34H48O7","C11977","14138"
"Avermectin A2a","C49H76O15","C11976","14137"
"Megalomicin A","C44H80N2O15","C11985","14146"
"Avermectin A1a","C49H74O14","C11984","14145"
"4,4'-Methylenebis(N,N-dimethylaniline)","C17H22N2","C14135","7846949"
"1,1,1-Trichloro-2,2-bis(4-hydroxyphenyl)ethane","C14H11Cl3O2","C14136","7846950"
"SSR 125543","C27H28ClFN2OS","C14129","7846943"
"2-tert-Butylphenol","C10H14O","C14130","7846944"
"Acotiamide","C21H30N4O5S","C14127","7846941"
"CGH 2466","C14H9Cl2N3S","C14128","7846942"
"2,2-(2-Chlorophenyl-4'-chlorophenyl)-1,1-dichloroethene","C14H8Cl4","C14133","7846947"
"Triphenylethylene","C20H16","C14134","7846948"
"Equol","C15H14O3","C14131","7846945"
"4-Octylphenol","C14H22O","C14132","7846946"
"beta-Alanyl-N(pai)-methyl-L-histidine","C10H16N4O3","C01262","4481"
"P1,P4-Bis(5'-guanosyl) tetraphosphate","C20H28N10O21P4","C01261","4480"
"P1,P4-Bis(5'-adenosyl) tetraphosphate","C20H28N10O19P4","C01260","4479"
"3-Hydroxy-N6,N6,N6-trimethyl-L-lysine","C9H21N2O3+","C01259","4478"
"3-(Imidazol-4-yl)-2-oxopropyl phosphate","C6H9N2O5P","C01267","4486"
"3'-Deoxydihydrostreptomycin 6-phosphate","C21H40N7O14P","C01266","4485"
"3',4',5-Trihydroxy-3,7-dimethoxyflavone","C17H14O7","C01265","4484"
"(6aS,11aS)-3,6a,9-Trihydroxypterocarpan","C15H12O5","C01263","4482"
"5-O-(1-Carboxyvinyl)-3-phosphoshikimate","C10H13O10P","C01269","4488"
"5-Amino-6-(5'-phosphoribosylamino)uracil","C9H15N4O9P","C01268","4487"
"11alpha-Hydroxygalanthamine","C17H21NO4","C12172","14319"
"Vicine","C10H16N4O7","C08437","10631"
"Triacanthine","C10H14N5+","C08435","10630"
"Phalloidin","C35H48N8O11S","C08439","10633"
"alpha-Amanitin","C39H54N10O14S","C08438","10632"
"Crotonoside","C10H13N5O5","C08432","10627"
"Cordycepin","C10H13N5O3","C08431","10626"
"6-Methylaminopurine","C6H7N5","C08434","10629"
"Amataine","C43H48N4O6","C08433","10628"
"Tentoxin","C22H30N4O4","C08441","10635"
"Phaseolotoxin","C14H33N10O7PS","C08440","10634"
"delta24-25-sitosterol","C29H48O","",""
"24-methyldesmosterol","C28H46O","","770928"
"3-cyanopyridine","C6H4N2","","150586"
"indole-3-acetyl-gln","C15H17N3O4","",""
"12-oxo-trans-10-dodecenoate","C12H20O3","",""
"indole-3-acetyl-glu","C15H16N2O5","",""
"1-18:1-2-16:0-monogalactosyldiacylglycerol","C43H80O10","",""
"1-18:3-2-trans-16:1-sn-glycerol-3-phosphate","C37H65O8P","",""
"1-18:2-2-16:2-monogalactosyldiacylglycerol","C43H74O10","",""
"1-18:1-2-16:1-monogalactosyldiacylglycerol","C43H78O10","",""
"Sumatrol","C23H22O7","C10532","12715"
"Cyproterone acetate","C24H29ClO4","C12804","583193"
"Cladribine","C10H12ClN5O3","C12806","583195"
"10-Deacetylbaccatin III","C29H36O10","C11700","13865"
"Fludiazepam","C16H12ClFN2O","C12788","583177"
"Betamethasone valerate","C27H37FO6","C12792","583181"
"Etomidoline","C23H29N3O2","C12794","583183"
"Erythromycin ethylsuccinate","C43H75NO16","C12796","583185"
"Tulobuterol hydrochloride","C12H19Cl2NO","C12798","583187"
"Trepibutone","C16H22O6","C12801","583190"
"Bezafibrate","C19H20ClNO4","C12802","583191"
"Fluorometholone","C22H29FO4","C12803","583192"
"(-)-Sativan","C17H18O4","C10526","12709"
"Spruceanol","C20H28O2","C09188","11380"
"HR 780","C27H26FNO3","C11699","13864"
"Hallactone B","C20H24O9S","C09105","11297"
"Hallactone A","C19H22O6","C09104","11296"
"Catharanthine","C21H24N2O2","C09107","11299"
"Carapanaubine","C23H28N2O6","C09106","11298"
"Hymatoxin A","C20H29O7S-","C09109","11301"
"Huratoxin","C34H48O8","C09108","11300"
"Inflexin","C24H32O7","C09111","11303"
"Ineketone","C20H30O3","C09110","11302"
"Ingenol 3,20-dibenzoate","C34H36O7","C09113","11305"
"Ingenol","C20H28O5","C09112","11304"
"Neoeriocitrin","C27H32O15","C09805","11993"
"Neohesperidin","C28H34O15","C09806","11994"
"Neoastilbin","C21H22O11","C09803","11991"
"(+)-Iridodial","C10H16O2","C09804","11992"
"Valtratum","C22H30O8","C09801","11989"
"Verbenalin","C17H24O10","C09802","11990"
"Specionin","C20H26O9","C09799","11987"
"Swertiamarin","C16H22O10","C09800","11988"
"Odoratol","C17H18O5","C09807","11995"
"Phellamurin","C26H30O11","C09808","11996"
"Sulfentrazone","C11H10Cl2F2N4O3S","C11125","13307"
"Spiroxamine","C18H35NO2","C11124","13306"
"Meclofenamate sodium","C14H10Cl2NNaO2","C02996","5905"
"N-Acetyl-L-histidine","C8H11N3O3","C02997","5906"
"Propiconazole","C15H17Cl2N3O2","C11121","13303"
"Rilmenidine","C10H16N2O","C11120","13302"
"N-Nitroso-1,3-thiazolidine","C3H6N2OS","C11119","13301"
"N-Methyl-2-pyrrolidinone","C5H9NO","C11118","13300"
"L-Methionine S-oxide","C5H11NO3S","C02989","5898"
"L-Palmitoylcarnitine","C23H45NO4","C02990","5899"
"L-2-Methyltryptophan","C12H14N2O2","C02983","5892"
"L-Fucose 1-phosphate","C6H13O8P","C02985","5894"
"L-Xylono-1,4-lactone","C5H8O5","C02994","5903"
"Maltose 6'-phosphate","C12H23O14P","C02995","5904"
"L-Rhamno-1,4-lactone","C6H10O5","C02991","5900"
"L-Tyrosyl-L-arginine","C15H23N5O4","C02993","5902"
"Tripdiolide","C20H24O7","C09202","11393"
"Tinyatoxin","C36H38O8","C09201","11392"
"Geissospermine","C40H48N4O3","C09200","11391"
"Terpenoid EA-I","C30H40O8","C09198","11390"
"Geissoschizoline","C19H26N2O","C09197","11389"
"Taxodone","C20H28O3","C09196","11388"
"Gabunine","C42H50N4O5","C09195","11387"
"Taxodione","C20H26O3","C09194","11386"
"Practolol","C14H22N2O3","C11696","13861"
"Triptolide","C20H24O6","C09204","11395"
"Gelsemicine","C20H26N2O4","C09203","11394"
"3-Indoleacetonitrile","C10H8N2","C02938","5857"
"Pinoquercetin","C16H12O7","C10120","12306"
"Primetin","C15H10O4","C10121","12307"
"Oxyayanin B","C18H16O8","C10116","12302"
"Pachypodol","C18H16O7","C10117","12303"
"Patuletin","C16H12O8","C10118","12304"
"Pedalitin","C16H12O7","C10119","12305"
"Nobiletin","C21H22O8","C10112","12298"
"Norwogonin","C15H10O5","C10113","12299"
"Orientin","C21H20O11","C10114","12300"
"Oxyayanin A","C18H16O8","C10115","12301"
"3-Methylbutanoyl-CoA","C26H44N7O17P3S","C02939","5858"
"Morindone","C15H10O5","C10376","12562"
"(1S,3R)-Nanaomycin A","C16H14O6","C10377","12563"
"Quinoline-3-carboxamides","C21H14FN3O2","C11694","13859"
"L-arabino-1,5-Lactone","C5H8O5","C05405","7772"
"3-Oxo-5alpha-steroid","C19H30O","C02940","5859"
"D-Gal alpha 1->6D-Gal alpha 1->6D-Glucose","C18H32O16","C05404","7771"
"Risarestat","C16H21NO4S","C13178","585242"
"3-Ketolactose","C12H20O11","C05403","7770"
"5-O-Methylembelin","C18H28O4","C10373","12559"
"Sorgolactone","C18H20O5","C09186","11378"
"Exserohilone","C20H22N2O6S2","C10593","12776"
"Brugine","C12H19NO2S2","C10849","13032"
"Tetrodotoxin","C11H17N3O8","C11692","13857"
"Cryptopleurine","C24H27NO3","C10586","12769"
"Cryogenine","C26H29NO5","C10585","12768"
"Damascenine","C10H13NO3","C10588","12771"
"Cynometrine","C16H19N3O2","C10587","12770"
"Elaeocarpidine","C17H21N3","C10590","12773"
"Decaline","C26H31NO5","C10589","12772"
"Elaeokanine C","C12H21NO2","C10592","12775"
"(+)-Elaeocarpine","C16H19NO2","C10591","12774"
"(1S,2R,4R)-Neoiso-dihydrocarveol","C10H18O","C11400","13574"
"(1S,4R)-Iso-dihydrocarvone","C10H16O","C11401","13575"
"3,4-Methylenedioxymethamphetamine","C11H15NO2","C07577","9780"
"(1R,2R,4R)-Dihydrocarveol","C10H18O","C11396","13570"
"(1R,2S,4R)-Neo-dihydrocarveol","C10H18O","C11397","13571"
"(1R,4R)-Dihydrocarvone","C10H16O","C11398","13572"
"(1S,2S,4R)-Iso-dihydrocarveol","C10H18O","C11399","13573"
"(-)-beta-Phellandrene","C10H16","C11392","13566"
"(-)-alpha-Terpineol","C10H18O","C11393","13567"
"(+)-Chrysanthenone","C10H14O","C11394","13568"
"(4R,6R)-cis-Carveol","C10H16O","C11395","13569"
"3-Carboxy-4-methoxy-N-methyl-2-pyridone","C8H9NO4","C04447","7076"
"Cannabinol","C21H26O2","C07580","9782"
"2-(3-Carboxy-3-aminopropyl)-L-histidine","C10H16N4O4","C04441","7070"
"1-(5-Phosphoribosyl)imidazole-4-acetate","C10H15N2O9P","C04437","7068"
"(Z)-2-Methyl-5-isopropylhexa-2,5-dienal","C10H16O","C04435","7066"
"(E)-4-Oxobut-1-ene-1,2,4-tricarboxylate","C7H6O7","C04434","7065"
"3,4-Dehydrothiomorpholine-3-carboxylate","C5H7NO2S","C04445","7074"
"3',5-Dihydroxy-3,4',7-trimethoxyflavone","C18H16O7","C04444","7073"
"3',4',5,7-Tetrahydroxy-3-methoxyflavone","C16H12O7","C04443","7072"
"2-Dehydro-3-deoxy-6-phospho-D-gluconate","C6H11O9P","C04442","7071"
"Testosterone propionate","C22H32O3","C08158","10358"
"Anastrozole","C17H19N5","C08159","10359"
"1,3,4,6-Tetrachloro-1,4-cyclohexadiene","C6H4Cl4","C06597","8823"
"L-4-Hydroxyphenylglycine","C8H9NO3","C12323","582713"
"gamma-Hexachlorocyclohexane","C6H6Cl6","C06595","8821"
"gamma-Pentachlorocyclohexene","C6H5Cl5","C06596","8822"
"Chlorohydroquinone","C6H5ClO2","C06601","8827"
"2,5-Dichlorophenol","C6H4Cl2O","C06602","8828"
"2,5-Dichloro-2,5-cyclohexadiene-1,4-diol","C6H6Cl2O2","C06599","8825"
"Bis-noryangonin","C13H10O4","C12085","14235"
"Amikacin","C22H43N5O13","C06820","9038"
"Lamprolobine","C15H24N2O2","C10769","12952"
"Lupanine","C15H24N2O","C10772","12955"
"Amifostine","C5H15N2O3PS","C06819","172354"
"Allopurinol","C5H4N4O","C06816","9034"
"(5Z,7E,9E,14Z,17Z)-Eicosapentaenoic acid","C20H30O2","C12083","14234"
"Nitrobenzene","C6H5NO2","C06813","9032"
"D-Xylose-5-phosphate","C5H11O8P","C06814","9033"
"Mesoridazine","C21H26N2OS2","C07143","9352"
"Tocainide","C11H16N2O","C07142","9351"
"Timolol","C13H24N4O3S","C07141","9350"
"alpha-L-Rhamnopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->2)-beta-D-glucuronopyranoside","C18H30O16","C12082","14233"
"Tolbutamide","C12H18N2O3S","C07148","9357"
"Soyasaponin I","C48H78O18","C08983","11175"
"Epinorgalanthamine","C16H19NO3","C12231","14376"
"Metaproterenol","C11H17NO3","C07144","9353"
"dTDP-beta-D-oliose","C16H26N2O14P2","C12446","582836"
"dTDP-beta-L-rhodinose","C16H26N2O13P2","C12447","582837"
"dTDP-beta-D-mycarose","C17H28N2O14P2","C12444","582834"
"Soyasaponin A1","C59H96O29","C08982","11174"
"Trachelanthamidine","C8H15NO","C12440","582830"
"dTDP-beta-L-daunosamine","C16H27N3O13P2","C12443","582833"
"2-Decarboxytetrangomycin","C20H14O7","C12438","582828"
"Phenanthroviridone aglycon","C18H11NO4","C12439","582829"
"2-Nitropropane","C3H7NO2","C02116","5196"
"alpha-Arbutin","C12H16O7","C12079","14230"
"2-Oxophytanate","C20H38O3","C02117","5197"
"Dehydroabietic acid","C20H28O2","C12078","14229"
"Toxol","C13H14O3","C08979","11171"
"4-Amino-4-deoxychorismate","C10H11NO5","C11355","13530"
"4-Hydroxyaniline","C6H7NO","C02372","5414"
"trans,trans,cis-Geranylgeranyl diphosphate","C20H36O7P2","C11356","13531"
"3-Oxododecanoic acid","C12H22O3","C02367","5411"
"2-Hydroxy-3-chloropenta-2,4-dienoate","C5H5ClO3","C11353","13528"
"4-Chlorobenzoate","C7H5ClO2","C02370","5412"
"2-Hydroxy-cis-hex-2,4-dienoate","C6H8O3","C11354","13529"
"Saikosaponin A","C42H68O13","C08975","11167"
"Rotenone","C23H22O6","C07593","9795"
"N1-Amidinostreptamine 6-phosphate","C7H18N4O7P+","C11351","13526"
"3-Methyloxindole","C9H9NO","C02366","5410"
"5,6-Dichloro-1,3-cyclohexadiene","C6H6Cl2","C11352","13527"
"Capsidiol","C15H24O2","C09627","11817"
"(S)-1-Phenylethanol","C8H10O","C11348","13523"
"Carotol","C15H26O","C09628","11818"
"(+)-trans-alpha-Irone","C14H22O","C11350","13525"
"beta-Caryophyllene","C15H24","C09629","11819"
"But-1-ene-1,2,4-tricarboxylate","C7H8O6","C04002","6715"
"8,11,14-Eicosatrienoylethanolamide","C22H39NO2","C13828","854073"
"Chloroform","CHCl3","C13827","854072"
"R-L3","C25H20FN3O","C13824","854069"
"alpha-Cedrol","C15H26O","C09631","11821"
"Retigabine","C16H18FN3O2","C13826","854071"
"O-Hexanoyl-adnosine monophosphate","C16H24N5O8P","C13825","854070"
"Chromanol 293B","C15H20N2O4S","C13820","854065"
"F4-Neuroprostane (7-series)","C22H34O5","C13819","854064"
"2S,3R-Didecanoyl-docosane-2,3-diol","C42H82O4","C13822","854067"
"Centarol","C15H26O2","C09632","11822"
"Azidopine","C27H26F3N5O5","C11282","13459"
"Anisomycin","C14H19NO4","C11281","13458"
"Tecostanine","C11H21NO","C09989","12175"
"Nimustine hydrochloride","C9H14Cl2N6O2","C11276","13453"
"Cetyltrimethylammonium bromide","C19H42BrN","C11275","13452"
"Tetrachlorosalicylanilide","C13H7Cl4NO2","C11274","13451"
"Thiobinupharidine","C30H42N2O2S","C09990","12176"
"Dolastatin 10","C42H68N6O6S","C11280","13457"
"Cetrimide","C17H38BrN","C11279","13456"
"Aflatoxin B1exo-8,9-epoxide-GSH","C27H29N3O13S","C11278","13455"
"Adefovir","C8H12N5O4P","C11277","13454"
"beta-Skytanthine","C11H21N","C09987","12173"
"(-)-Anabasine","C10H14N2","C11357","13532"
"Diffutin","C23H28O10","C09636","11826"
"(-)-Anaferine","C13H24N2O","C11358","13533"
"Jasminine","C11H12N2O3","C09985","12171"
"Rhexifoline","C11H13NO3","C09986","12172"
"D-Fructose 1-phosphate","C6H13O9P","C01094","4329"
"Abscisic alcohol","C15H22O3","C13456","586196"
"Abscisic aldehyde","C15H20O3","C13455","586195"
"10-Deoxysarpagine","C19H22N2O","C11635","13800"
"Cresol","C21H24O3","C13457","586197"
"Travoprost","C26H35F3O6","C13462","586201"
"Triadimenol","C14H18ClN3O2","C11127","13309"
"Ezetimibe","C24H21F2NO3","C13464","853866"
"Silodosin","C25H32F3N3O4","C13463","586202"
"Reglitazar","C22H20N2O5","C13469","586207"
"Omapatrilat","C19H24N2O4S2","C13468","586206"
"Acerosin","C18H16O8","C09982","12168"
"Phantomolin","C21H26O6","C09527","11718"
"Vellosimine","C19H20N2O","C11634","13799"
"1-Octen-3-ol","C8H16O","C14272","161810"
"5alpha-Androstane-3,11,17-trione","C19H26O3","C14269",""
"3-Chlorophenol","C6H5ClO","C14270","151043"
"Furan","C4H4O","C14275","151144"
"4-(3,5-Diphenylcyclohexyl)phenol","C24H24O","C14276",""
"1,2-Octanediol","C8H18O2","C14273","157516"
"4-Heptyloxybenzoic acid","C14H20O3","C14274","662017"
"Betanidin","C18H16N2O8","C08539","10732"
"3,4-Diphenyltetrahydrofuran","C16H16O","C14277","440875"
"1,1,2-Triphenylpropane","C21H20","C14278",""
"benzyladenine","C12H11N5","","203687"
"cis-zeatin riboside","C15H21N5O5","","739131"
"2-Hydroxydecanedioic acid","C10H18O5","","705059"
"3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid","C9H16O9","","700413"
"(1R,2S)-1-Hydroxypropane-1,2,3-tricarboxylate","C6H8O7","C00451","3739"
"4-Hydroxymandelonitrile","C8H7NO2","C00650","3921"
"dCTP","C9H16N3O13P3","C00458","3742"
"dTTP","C10H17N2O14P3","C00459","3743"
"dUTP","C9H15N2O14P3","C00460","3744"
"Indole","C8H7N","C00463","3747"
"4-Methylene-L-glutamate","C6H9NO4","C00651","3922"
"D-Arabinono-1,4-lactone","C5H8O5","C00652","3923"
"Estrone","C18H22O2","C00468","3751"
"Picrotoxinin","C15H16O6","C09529","11720"
"D-Glucose 1,6-bisphosphate","C6H14O12P2","C00660","3929"
"Glyceraldehyde 3-phosphate","C3H7O6P","C00661","3930"
"Phenylacetylglycine methyl ester","C11H13NO3","","293460"
"Sialyllactose","C23H39NO19","","700666"
"Pentadecanoic acid","C15H30O2","","256215"
"N-Stearoylsphingosine","C36H71NO3","",""
"Murocholic acid","C24H40O4","","81301"
"Propionylglycine methyl ester","C6H11NO3","","249306"
"Pseudouroporphyrin","C39H38N4O14","","745897"
"9,10,18-trihydroxystearate","C18H36O5","",""
"N-Lignoceroylsphingosine","C42H83NO3","",""
"3b,17a-Dihydroxy-5a-androstane","C19H32O2","",""
"kaempferol-3-rhamnoside-7-rhamnoside","C27H30O14","",""
"3-Hydroxy-2-methyl-[R-(R,R)]-butanoic acid","C5H10O3","",""
"2,3-Dihydroxyvaleric acid","C5H10O4","",""
"isopentenyladenine-9-N-glucoside","C16H23N5O5","",""
"2-Undecanone","C11H22O","C01875","4989"
"3b,7a,12a-Trihydroxy-5b-cholanoic acid","C24H40O5","",""
"Glycerone sulfate","C3H6O6S","C02543","5548"
"Droperidol","C22H22FN3O2","C06974","9188"
"Echothiophate","C9H23NO3PS+","C06975","9189"
"Dronabinol","C21H30O2","C06972","9186"
"Doxycycline","C22H24N2O8","C06973","9187"
"Doxazosin","C23H25N5O5","C06970","9184"
"Doxepin","C19H21NO","C06971","9185"
"Provincialin","C27H34O10","C09533","11724"
"Dehydrovomifoliol","C13H18O3","C02533","5540"
"Dobutamine","C18H23NO3","C06967","9181"
"2-Ethylhexyl phthalate","C16H22O4","C03343","6186"
"Dorzolamide","C10H16N2O4S3","C06969","9183"
"Estradiol-17alpha","C18H24O2","C02537","5544"
"6-Mercaptopurin","C5H4N4S","C02380","5422"
"6-Hydroxymellein","C10H10O4","C02379","5421"
"Amino acid(Arg-)","C6H14N4O2","C02385","5424"
"Thalicoside A","C42H70O14","C08985","11177"
"Methylazoxymethanol","C2H6N2O2","C02390","5426"
"Benzosemiquinone","C6H6O2","C02389","5425"
"Ursolic acid","C30H48O3","C08988","11180"
"Cinnamyl alcohol","C9H10O","C02394","5428"
"Formyl phosphate","CH3O5P","C02405","5438"
"Demethylmacrocin","C44H73NO17","C02400","5434"
"dTDPgalactose","C16H26N2O16P2","C02097","5181"
"Mitomycin","C15H18N4O5","C06681","8906"
"Polhovolide","C23H32O8","C09532","11723"
"(-)-Salsoline","C11H15NO2","C09640","11830"
"20alpha-Hydroxy-4-pregnen-3-one","C21H32O2","C04042","6743"
"1-Palmitoylglycerol 3-phosphate","C19H39O7P","C04036","6739"
"(-)-Acanthocarpan","C17H12O7","C10198","12384"
"2',6'-Dihydroxy-4'-methoxydihydrochalcone","C16H16O4","C09644","11834"
"Sinomenine","C19H23NO4","C09643","11833"
"delta1-Pyrroline 2-carboxylate","C5H7NO2","C04027","6733"
"Velloquercetin","C20H16O7","C10194","12380"
"Yangonin","C15H14O4","C09980","12166"
"Xanthochymol","C38H50O6","C09979","12165"
"7,3'-Dihydroxy-4'-methoxy-8-methylflavan","C17H18O4","C09646","11836"
"Cuauhtemone","C15H24O3","C09645","11835"
"Betavulgarin","C17H12O6","C10201","12387"
"Anhydroglycinol","C15H10O4","C10200","12386"
"3,4-Dihydroxyphenylacetaldehyde","C8H8O3","C04043","6744"
"3-(2,3-Dihydroxyphenyl)propanoate","C9H10O4","C04044","6745"
"4-Hydroxyphthalate","C8H6O5","C06680","8905"
"2-Amino-4-oxopentanoic acid","C5H9NO3","C03341","6184"
"Aminophenol","C6H7NO","C01781","4911"
"Aldosterone","C21H28O5","C01780","4910"
"Albendazole","C12H15N3O2S","C01779","4909"
"Aculeacin A","C51H85N7O16","C01776","4907"
"2-Coumarate","C9H8O3","C01772","4905"
"2-Butenoate","C4H6O2","C01771","4904"
"1,4-Lactone","C4H6O2","C01770","4903"
"(S)-Acetoin","C4H8O2","C01769","4902"
"Arylmercury","C6H5Hg","C01783","4913"
"Arene oxide","C6H6O","C01782","4912"
"Sphinganine","C18H39NO2","C00836","4094"
"2-Chloroethanol","C2H5ClO","C06753","8974"
"1,2-Dichloroethane","C2H4Cl2","C06752","8973"
"Prenyl-L-cysteine","C8H15NO2S","C06751","8972"
"6-Hydroxycyclohex-1-enecarbonyl-CoA","C28H44N7O18P3S","C06749","8970"
"Isopropylamine","C3H9N","C06748","8969"
"Phenylmethanesulfonyl fluoride","C7H7FO2S","C06747","8968"
"N-Acetylphenylethylamine","C10H13NO","C06746","8967"
"2-(2-Hydroxyphenyl)benzenesulfinate","C12H10O3S","C06742","8964"
"cis-p-Coumarate","C9H8O3","C06738","8960"
"(Z)-11-Tetradecenoyl-CoA","C35H60N7O17P3S","C06737","8959"
"2,3,5-Trihydroxytoluene","C7H8O3","C03338","6181"
"2-Amino-3-oxoadipate","C6H9NO5","C05520","7865"
"L-Allothreonine","C4H9NO3","C05519","7864"
"5-Amino-4-imidazole carboxylate","C4H5N3O2","C05516","7862"
"5-Ureido-4-imidazole carboxylate","C5H6N4O3","C05515","7861"
"Deoxyinosine","C10H12N4O4","C05512","7859"
"16-Glucuronide-estriol","C24H32O9","C05504","7857"
"Estradiol-17beta 3-glucuronide","C24H32O8","C05503","7856"
"22beta-Hydroxycholesterol","C27H46O2","C05502","7855"
"5-Methylcytosine (in DNA)","C5H9N3O","C05523","7867"
"Cytosine (in DNA)","C4H5N3O","C05522","7866"
"Inosine 5'-tetraphosphate","C10H16N4O17P4","C03614","6400"
"L-threo-3-Methylaspartate","C5H9NO4","C03618","6402"
"CDP-3,6-dideoxy-D-glucose","C15H25N3O14P2","C03598","6389"
"CDP-3,6-dideoxy-D-mannose","C15H25N3O14P2","C03599","6390"
"7alpha-Hydroxycholesterol","C27H46O2","C03594","6385"
"8,11,14-Eicosatrienoyl-CoA","C41H68N7O17P3S","C03595","6386"
"D-Erythrulose 4-phosphate","C4H9O7P","C03604","6394"
"D-Hamamelose 2(1)-phosphate","C6H13O9P","C03606","6395"
"Carboxymethyloxysuccinate","C6H8O7","C03600","6391"
"Chloramphenicol 3-acetate","C13H14Cl2N2O6","C03601","6392"
"Sirohydrochlorin","C42H46N4O16","C05778","8073"
"Coenzyme F430","C41H51N6NiO13+","C05777","8072"
"2-Quinolinecarboxylic acid","C10H7NO2","C06325","8561"
"1(2H)-Isoquinolinone","C9H7NO","C06324","8560"
"1,6-Dihydroxy-cis-2,4-cyclohexadiene-1-carboxylic acid","C7H8O4","C06321","8557"
"Precorrin 6X","C44H54N4O16","C06320","8556"
"Isoquinoline","C9H7N","C06323","8559"
"S-1,5-Cyclohexadiene-1-carboxylate coenzymeA","C28H42N7O17P3S","C06322","8558"
"4-Hydroxy-3-methoxy-benzenemethanol","C8H10O3","C06317","8553"
"D-erythro-Ascorbate","C5H6O5","C06316","8552"
"Precorrin 6Y","C44H56N4O16","C06319","8555"
"(3S,4R)-3,4-Dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate","C8H8O6","C06318","8554"
"Cholest-4-en-3-one","C27H44O","C00599","3875"
"3-Chlorocatechol","C6H5ClO2","C05618","7936"
"Propantheline chloride","C23H30ClNO3","C11762","13926"
"Bryostatins","C47H68O17","C05149","7567"
"3,5-Dibromo-4-hydroxybenzonitrile","C7H3Br2NO","C04178","6856"
"Mureidomycin A","C38H48N8O12S","C12007","14166"
"Liposidomycin B","C42H67N5O21S","C12006","14165"
"Ceforanide","C20H21N7O6S2","C06884","9101"
"Cefotaxime","C16H17N5O7S2","C06885","9102"
"Cefonicid","C18H18N6O8S3","C06882","9099"
"Cefoperazone","C25H27N9O8S2","C06883","9100"
"Cefazolin","C14H14N8O4S3","C06880","9097"
"Cefixime","C16H15N5O7S2","C06881","9098"
"Cefadroxil","C16H17N3O5S","C06878","9095"
"Cefamandole","C18H18N6O5S2","C06879","9096"
"Pikromycin","C28H47NO8","C11999","14160"
"Narbomycin","C28H47NO7","C11998","14159"
"Ficine","C20H19NO4","C10594","12777"
"N-Cyclopropylammelide","C6H8N4O2","C14149","7846961"
"Cyclopropylamine","C3H7N","C14150","7846962"
"delta-Tocopherol","C27H46O2","C14151","7846963"
"beta-Tocopherol","C28H48O2","C14152","7846964"
"alpha-Tocotrienol","C29H44O2","C14153","7846965"
"beta-Tocotrienol","C28H42O2","C14154","7846966"
"gamma-Tocotrienol","C28H42O2","C14155","7846967"
"delta-Tocotrienol","C27H40O2","C14156","7846968"
"Stylisterol A","C28H46O3","C14157","7846969"
"Stylisterol B","C28H46O4","C14158","7846970"
"Glafenine","C19H17ClN2O4","C12785","583174"
"Emorfazone","C11H17N3O3","C12787","583176"
"Phlorizin","C21H24O10","C01604","4758"
"Cyclacillin","C15H23N3O4S","C12766","583155"
"Dibenzthion","C17H18N2S2","C12767","583156"
"Ipriflavone","C18H16O3","C12771","583160"
"Midecamycin","C41H67NO15","C12772","583161"
"Fenbufen","C16H14O3","C12777","583166"
"Bentiromide","C23H20N2O5","C12779","583168"
"Terguride","C20H28N4O","C12781","583170"
"Sulfametomidine","C12H14N4O3S","C12782","583171"
"L-(+)-Erythrose","C4H8O4","","679879"
"l-(+)-threose","C4H8O4","","678989"
"3,4-dehydro-d/l-proline","C5H7NO2","","680495"
"l-(-) threitol","C4H10O4","","272831"
"Carbamoylmethylaminodiacetic acid","C6H10N2O5","","694467"
"Phthalate","C8H6O4","C01606","4759"
"1,3-DIMETHYLUREA","C3H8N2O","","150345"
"3-Acetylphenylboronic acid","C8H9BO3","",""
"1-Propanaminium, 2-(acetoxy)-3-carboxy-N,N,N-trimethyl-, hydroxide, inner salt, (+-)- (9CI)","C9H17NO4","","697490"
"1,5-Dimethyl-2-phenyl-4-aminopyrazoline","C11H13N3O","","149712"
"Decaprenol phosphate","C50H83O4P","C02970","5883"
"Plicamycin","C52H76O24","C07364","9568"
"D-Glucosyl-D-mannose","C12H22O11","C02964","5879"
"D-Hexose 6-phosphate","C6H13O9P","C02965","5880"
"GDP-6-deoxy-D-talose","C16H25N5O15P2","C02977","5888"
"Glycerol 2-phosphate","C3H9O6P","C02979","5889"
"Ethyl 3-oxohexanoate","C8H14O3","C02975","5886"
"Prazepam","C19H17ClN2O","C07366","9570"
"Hydroxyanthraquinone","C14H8O3","C02980","5890"
"L-2-Hydroxyphytanate","C20H39O3","C02982","5891"
"1,2-Dihydroxy-3-keto-5-methylthiopentene","C6H10O3S","","2519"
"Prazosin","C19H21N5O4","C07368","9572"
"3,4,6-Trichloro-cis-1,2-dihydroxycyclohexa-3,5-diene","C6H5Cl3O2","C12832","583221"
"2,3,5-Trichloro-cis,cis-muconate","C6H3Cl3O4","C12833","583222"
"Mizoribine","C9H13N3O6","C12830","583219"
"Nicotine glucuronide","C16H23N2O6","","704495"
"Iotroxic acid","C22H18I6N2O9","C12826","583215"
"Bromisovalum","C6H11BrN2O2","C12829","583218"
"Ibudilast","C14H18N2O","C12823","583212"
"Amcinonide","C28H35FO7","C12825","583214"
"Metharbital","C9H14N2O3","C12820","583209"
"4-Oxo-4-(3-pyridyl)-butanamide","C9H10N2O2","","585026"
"D-Glucono-1,5-lactone 6-phosphate","C6H11O9P","C01236","4457"
"1-alpha-D-Galactosyl-myo-inositol","C12H22O11","C01235","4456"
"N2-(ADP-D-Ribosyl)-L-arginine","C21H35N9O15P2","","2443"
"(15Z)-12-Oxophyto-10,15-dienoate","C18H28O3","C01226","4448"
"sn-glycero-3-Phospho-1-inositol","C9H19O11P","C01225","4447"
"Guanosine 3',5'-bis(diphosphate)","C10H17N5O17P4","C01228","4450"
"4,4-Dimethyl-14a-hydroxymethyl-5a-cholesta- 8,24-dien-3b-ol","C30H50O2","","853826"
"alpha-D-Glucose 1,6-bisphosphate","C6H14O12P2","C01231","4453"
"all-trans-Hexaprenyl diphosphate","C30H52O7P2","C01230","4452"
"1-Aminocyclopropane-1-carboxylate","C4H7NO2","C01234","4455"
"sn-glycero-3-Phosphoethanolamine","C5H14NO6P","C01233","4454"
"O6-Methyl-2'-deoxyguanosine","C11H15N5O4","C05031","7501"
"Maleamate","C4H5NO3","C01596","4751"
"Vomitoxin","C15H20O6","C09747","11935"
"Warburganal","C15H22O3","C09748","11936"
"Valerenic acid","C15H22O2","C09743","11931"
"alpha-Vetivone","C15H22O","C09744","11932"
"beta-Vetivone","C15H22O","C09745","11933"
"Verrucarin A","C27H34O9","C09746","11934"
"Tetradymol","C15H22O2","C09739","11927"
"Thujopsene","C15H24","C09740","11928"
"Trichodermin","C17H24O4","C09741","11929"
"Trichothecin","C19H24O5","C09742","11930"
"(5Z,8Z,11Z,14Z)-Icosatetraenoic acid","C20H24O2T8","C00219","3519"
"Methylamine","CH5N","C00218","3518"
"Pyrithioxine","C16H20N2O4S2","C13911","854156"
"Adenosine","C10H13N5O4","C00212","3512"
"Cobamide","C54H83CoN11O14P+2","C00210","3510"
"Oxalate","C2H2O4","C00209","3509"
"Maltose","C12H22O11","C00208","3508"
"D-Glutamate","C5H9NO4","C00217","3517"
"D-Arabinose","C5H10O5","C00216","3516"
"Thymidine","C10H14N2O5","C00214","3514"
"Sarcosine","C3H7NO2","C00213","3513"
"Podecdysone B","C27H42O6","C08832","11025"
"Miroestrol","C20H22O6","C08831","11024"
"Sclareol","C20H36O2","C09183","11375"
"Royleanone","C20H28O3","C09182","11374"
"Isofucosterol","C29H48O","C08821","11014"
"Inokosterone","C27H44O7","C08819","11012"
"Fucosterol","C29H48O","C08817","11010"
"Cyasterone","C29H44O8","C08816","11009"
"24-Methylenecycloartanol","C31H52O","C08830","11023"
"Makisterone B","C28H46O7","C08829","11022"
"Lophenol","C28H48O","C08825","11018"
"Lichesterol","C28H44O","C08823","11016"
"Ioxilan","C18H24I3N3O8","C13912","854157"
"Linamarin","C10H17NO6","C01594","4749"
"N,N-Dimethylsphing-4-enine","C20H41NO2","C13914","854158"
"(9Z,12Z)-Octadecadienoic acid","C18H32O2","C01595","4750"
"Hexadecasphinganine","C16H35NO2","C13915","854159"
"Futoquinol","C21H22O5","C10574","12757"
"Calycanthine","C22H26N4","C10573","12756"
"Balsoxine","C17H15NO3","C10572","12755"
"Aspergillic acid","C12H20N2O2","C10571","12754"
"Annuloline","C20H19NO4","C10570","12753"
"Androcymbine","C21H25NO5","C10569","12752"
"Anantine","C15H15N3O","C10568","12751"
"Alchornine","C11H17N3O","C10567","12750"
"Alchorneine","C12H19N3O","C10566","12749"
"Acutumidine","C18H22ClNO6","C10565","12748"
"ICI D1694","C21H22N4O6S","C11372","13546"
"Temocaprilat","C21H24N2O5S2","C11373","13547"
"N-Ethylmaleimide-S-glutathione","C16H22N4O8S","C11370","13544"
"Nafenopin","C20H22O3","C11371","13545"
"Undecaprenyl-diphospho-N-acetylmuramoyl-L-alanyl-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine","C87H143N7O23P2","C05897","8185"
"Ubiquinone-10","C59H90O4","C11378","13552"
"GW1843","C27H24N4O6","C11374","13548"
"SN38 glucuronide carboxylate form","C28H29N2O12-","C11375","13549"
"Cinchonidine","C19H22N2O","C11379","13553"
"Apocynin","C9H10O3","C11380","13554"
"beta-D-Glucosyl-1-phosphoundecaprenol","C61H101O9P","C04403","7039"
"S-Methyl-3-phospho-1-thio-D-glycerate","C4H9O6PS","C04399","7038"
"(2S,3S)-3-Hydroxy-2-methylbutanoyl-CoA","C26H44N7O18P3S","C04405","7041"
"trans-4-Hydroxycyclohexanecarboxylate","C7H12O3","C04404","7040"
"2-Amino-3-carboxymuconate semialdehyde","C7H7NO5","C04409","7044"
"1,2-Didecanoyl-sn-phosphatidylinositol","C29H55O13P","C04407","7042"
"4-O-beta-D-Glucosyl-4-hydroxycinnamate","C15H18O8","C04415","7047"
"(2R,3S)-3-Isopropylmalate","C7H12O5","C04411","7045"
"N-Acetyl-L-phenylalanyl-L-diiodotyrosine","C20H20I2N2O5","C04418","7050"
"5alpha-Ergosta-7,22-diene-3beta,5-diol","C28H46O2","C04416","7048"
"Tos-Phe-CH2Cl","C17H18ClNO3S","C02088","5173"
"2,4,5-Trichloro-2,5-cyclohexadiene-1-ol","C6H5Cl3O","C06598","8824"
"trans-1,2-Dichloroethene","C2H2Cl2","C06791","9011"
"cis-1,2-Dichloroethene","C2H2Cl2","C06792","9012"
"Vinyl chloride","C2H3Cl","C06793","9013"
"Granaticin","C22H20O10","C06799","9018"
"Dexylosylbenanomicin A","C34H33NO15","C06787","9007"
"Benanomicin A","C39H41NO19","C06788","9008"
"Tetrachloroethene","C2Cl4","C06789","9009"
"Trichloroethene","C2HCl3","C06790","9010"
"Matrine","C15H24N2O","C10774","12957"
"Aflatoxin B1","C17H12O6","C06800","9019"
"Tetracenomycin C","C23H20O11","C06801","9020"
"Lupinine","C10H19NO","C10773","12956"
"4-Demethylpremithramycinone","C20H16O9","C12382","582772"
"Premithramycinone","C21H18O9","C12383","582773"
"Premithramycin A1","C27H28O12","C12384","582774"
"Premithramycin A2'","C33H38O15","C12385","582775"
"Tetracenomycin B2","C22H16O8","C12378","582768"
"Amiodarone","C25H29I2NO3","C06823","9041"
"Tetracenomycin X","C24H20O11","C12380","582770"
"Elloramycin A","C32H36O15","C12381","582771"
"Amitriptyline","C20H23N","C06824","9042"
"Mascaroside","C26H36O11","C09132","11324"
"Premithramycin A3","C41H52O18","C12387","582777"
"Bilobol","C21H34O2","C10770","12953"
"Amiloride","C6H8ClN7O","C06821","9039"
"Thioglycolate","C2H4O2S","C02086","5171"
"Amantadine","C10H17N","C06818","9036"
"Fluorene","C13H10","C07715","9917"
"Leontiformine","C15H26N2O","C10771","12954"
"Ascosalitoxin","C15H20O4","C10766","12949"
"Cajanol","C17H16O6","C10204","12390"
"Alprazolam","C17H13ClN4","C06817","9035"
"Jamine","C21H35N3","C10768","12951"
"Dimethamine","C24H32N4O2","C10767","12950"
"Chelilutine","C22H20NO5+","C12229","14374"
"Sanguirubine","C22H20NO5+","C12230","14375"
"Coumestrol","C15H8O5","C10205","12391"
"Chelerythrine","C21H18NO4+","C12227","14372"
"10-Nitro-9Z,12Z-octadecadienoic acid","C18H31NO4","C13800","854045"
"(+)-Hydrastine","C21H21NO6","C13799","854044"
"8-(5-Hexyl-furan-2-yl)-octanoic acid","C18H30O3","C13798","854043"
"Sanguilutine","C23H24NO5+","C12228","14373"
"N-Butyl-beta-carboline-3-carboxylate","C16H16N2O2","C13805","854050"
"ORG 20599","C25H40ClNO3","C13804","854049"
"Alphaxolone","C21H32O3","C13803","854048"
"Prostaglandin D3","C20H30O5","C13802","854047"
"Lycoramine","C17H23NO3","C12233","14378"
"Levuglandin E2","C20H32O5","C13807","854052"
"Philanthotoxin 343","C23H41N5O3","C13806","854051"
"Epinorlycoramine","C16H21NO3","C12234","14379"
"Cefsulodin","C22H20N4O8S2","C11253","13430"
"Tetrahydropalmatine","C21H25NO4","C02890","5820"
"Carboxin","C12H13NO2S","C11255","13432"
"Carmine","C22H20O13","C11254","13431"
"Calcein AM","C46H46N2O23","C11257","13434"
"Metaraminol","C9H13NO2","C07146","9355"
"Bicozamycin","C12H18N2O7","C11259","13436"
"Bitertanol","C20H23N3O2","C11258","13435"
"3-Amino-1,2,4-triazole","C2H4N4","C11261","13438"
"(S)-Propane-1,2-diol","C3H8O2","C02917","5840"
"Bowdichione","C16H10O6","C10202","12388"
"Sanguinine","C16H19NO3","C12232","14377"
"Coproporphyrinogen III","C36H44N4O8","C03263","6127"
"Venlafaxine","C17H27NO2","C07187","9396"
"Valacyclovir","C13H21ClN6O4","C07184","9393"
"ADP-D-ribose","C15H23N5O14P2","C01882","4995"
"2-Chloromaleylacetate","C6H5ClO5","C06329","8565"
"Trimeprazine","C18H22N2S","C07172","9381"
"beta-Cyclopiazonate","C20H22N2O3","C02899","5828"
"Methdilazine","C18H20N2S","C07175","9384"
"Trimethaphan","C22H25N2OS+","C07174","9383"
"Trimethobenzamide","C21H28N2O5","C07178","9387"
"Assoanine","C17H17NO2","C12235","14380"
"Tromethamine","C4H11NO3","C07182","9391"
"Camptothecin","C20H16N2O4","C01897","5009"
"Oxoassoanine","C17H15NO3","C12236","14381"
"Bleomycin B2","C54H82N20O21S2","C01895","5008"
"Cajanin","C16H12O6","C10203","12389"
"N-Acetylanthranilate","C9H9NO3","C06332","8568"
"p-Menthane-3,8-diol","C10H20O2","C02904","5831"
"2-Aminobenzenesulfonate","C6H7NO3S","C06333","8569"
"Hydrocortisone butyrate propionate","C28H40O7","C13358","586102"
"Pirarubicin","C32H37NO12","C13357","586101"
"Aniracetam","C12H13NO3","C13355","586099"
"Hepronicate","C28H31N3O6","C13354","586098"
"Astromicin sulfate","C17H39N5O14S2","C13353","586097"
"3-Ketosucrose","C12H20O11","C05731","8033"
"Vedaprofen","C19H22O2","C13346","586090"
"p-Hydroxypropiophenone","C9H10O2","C13342","586086"
"L-Glutamyl 1-phosphate","C5H10NO7P","C05765","8060"
"Repirinast","C20H21NO5","C13362","586106"
"Imiprothrin","C17H22N2O4","C13361","586105"
"Daidzein","C15H10O4","C10208","12394"
"Trypanothione","C27H49N9O10S2","C02090","5175"
"2-Deoxy-D-ribose 1,5-bisphosphate","C5H12O10P2","C04175","6854"
"Afzelechin-(4alpha->8)-afzelechin","C30H26O10","C10209","12395"
"Lucenin-2","C27H30O16","C10102","12288"
"13-(2-Methylcrotonoyl)oxylupanine","C20H30N2O3","C04170","6851"
"2,3-Dihydro-2,3-dihydroxybenzoate","C7H8O4","C04171","6852"
"(+/-)-6-Hydroxy-3-oxo-alpha-ionol","C13H20O3","C04166","6848"
"N-Acetyl-beta-D-galactosamine","C8H15NO6","C05021","7497"
"(+/-)-trans-Acenaphthene-1,2-diol","C12H10O2","C04167","6849"
"2,5-Dioxopentanoate","C5H6O4","C00433","3722"
"N-Carbamoylputrescine","C5H13N3O","C00436","3725"
"Cristacarpin","C21H22O5","C10206","12392"
"5-Aminopentanoate","C5H11NO2","C00431","3720"
"divinyl protochlorophyllide a","C35H30MgN4O5","",""
"Neocarlinoside","C26H28O15","C10109","12295"
"(S)-Lactaldehyde","C3H6O2","C00424","3714"
"Dehydroascorbate","C6H6O6","C00425","3715"
"6-deoxocastasterone","C28H50O4","",""
"6alpha-hydroxy-6-deoxocastasterone","C28H50O5","",""
"13(S)-hydroperoxylinolenate","C18H30O4","","730469"
"1-18:3-2-18:3-sn-glycerol-phosphocholine","C44H76NO8P","","758969"
"3-dehydroteasterone","C28H46O4","",""
"dihydrozeatin-9-N-glucoside-O-glucoside","C22H35N5O11","",""
"trans-zeatin-O-glucoside-7-N-glucoside","C22H33N5O11","",""
"Tauroursodeoxycholic acid","C26H45NO6S","","682426"
"2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate","C11H12O6","C05817","8112"
"Cyclokievitone","C20H18O6","C10207","12393"
"Bay-K-8644","C16H15F3N2O4","C13758","586344"
"Musca-aurin VII","C15H16N4O6","C08562","10755"
"Plantamajoside","C29H36O16","C10485","12668"
"trans-Cinnamoyl beta-D-glucoside","C15H18O7","C04164","6846"
"1b,3a,12a-Trihydroxy-5b-cholanoic acid","C24H40O5","",""
"12-Ketodeoxycholic acid","C24H48O4","","260900"
"2b,3a,7a,12a-Tetrahydroxy-5b-cholanoic","C24H40O6","",""
"2-Hydroxy-3-methylpentanoic acid","C6H12O3","","742073"
"Agrimoniin","C82H54O52","C10210","12396"
"3a,4b,7a-Trihydroxy-5b-cholanoic acid","C24H40O5","","772497"
"16-Oxoandrostenediol","C19H28O3","","114330"
"3-Amino-2-piperidone","C5H10N2O","",""
"3a,16a-Dihydroxyandrostenone","C19H28O3","",""
"3-Hydroxysuberic acid","C8H14O5","",""
"Phytanoyl-CoA","C41H74N7O17P3S","C02060","5149"
"Phylloquinone","C31H46O2","C02059","5148"
"Indolelactate","C11H11NO3","C02043","5133"
"Eicosanoyl-CoA","C41H74N7O17P3S","C02041","5132"
"L-Hyoscyamine","C17H23NO3","C02046","5135"
"L-Erythrulose","C4H8O4","C02045","5134"
"Linoleoyl-CoA","C39H66N7O17P3S","C02050","5139"
"Laminaribiose","C12H22O11","C02048","5137"
"Phenylalanine","C9H11NO2","C02057","5146"
"Maltotetraose","C24H42O21","C02052","5141"
"3,4-Dihydroxybutyric acid","C4H8O4","","728458"
"3b,16b-Dihydroxyandrostenone sulfate","C19H28O6S","",""
"Alnusiin","C41H26O26","C10211","12397"
"3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid","C24H40O6","",""
"Orthosporin","C12H12O5","C09958","12144"
"Gentianadine","C8H7NO2","C09957","12143"
"Ohioensin-A","C23H16O5","C09956","12142"
"2-Methylbutyrylglycine","C7H13NO3","","771223"
"Nepodin","C13H12O3","C09954","12140"
"Monocerin","C16H20O6","C09953","12139"
"Methysticin","C15H14O5","C09952","12138"
"Maclurin","C13H10O6","C09951","12137"
"3a,4b,12a-Trihydroxy-5b-cholanoic acid","C24H40O5","",""
"Gentianaine","C6H7NO3","C09960","12146"
"2-Phenylbutyric acid","C10H12O2","","294275"
"18-Oxocortisol","C21H28O6","","700434"
"3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanate","C24H40O5","C00695","3963"
"3a,7b,12a-Trihydroxyoxocholanyl-Glycine","C26H43NO6","",""
"Isoorientin","C21H20O11","C01821","4945"
"Indoleamine","C8H8N2","C01819","4943"
"Haloperidol","C21H23ClFNO2","C01814","4938"
"Haloacetate","C2H3O2","C01812","4936"
"Testolactone","C19H24O3","C02197","5265"
"Heptadecane","C17H36","C01816","4940"
"Discadenine","C14H20N6O2","C01804","4930"
"3-Oxosteroid","C19H30O","C01876","4990"
"Galactarate","C6H10O8","C01807","4932"
"GTP-gamma-S","C10H16N5O13P3S","C01806","4931"
"Hypercalin B","C33H42O5","C09941","12127"
"4-Oxoproline","C5H7NO3","C01877","4991"
"Succinate semialdehyde-thiamin diphosphate anion","C16H24N4O10P2S","C05816","8111"
"UDP-L-rhamnose","C15H24N2O16P2","C02199","5267"
"5-Oxoproline","C5H7NO3","C01879","4992"
"beta-Farnesene","C15H24","C09666","11856"
"alpha-Farnesene","C15H24","C09665","11855"
"3-Dehydro-2-deoxy-D-gluconate","C6H10O6","C03926","6654"
"3-Hydroxy-4H-pyrid-4-one","C5H5NO2","C03927","6655"
"2,4-Dioxotetrahydropyrimidine","C4H6N2O2","C03919","6648"
"2-(Methylthio)ethanesulfonate","C3H8O3S2","C03920","6649"
"2-Dehydro-3-deoxy-D-glucarate","C6H8O7","C03921","6650"
"3,5-Dibromo-4-hydroxybenzoate","C7H4Br2O3","C03925","6653"
"Diacetoxyscirpenol","C19H26O7","C09662","11852"
"1-Oleoylglycerophosphocholine","C26H53NO7P+","C03916","6645"
"17beta-Hydroxyandrostan-3-one","C19H30O2","C03917","6646"
"2,4-Dichloro-cis,cis-muconate","C6H4Cl2O4","C03918","6647"
"Cyprodinil","C14H15N3","C10914","13097"
"Bispyribac acid","C19H18N4O8","C10915","13098"
"Z-Phe-Phe-CHN2","C25H27N4O+","C02202","5270"
"6-Hexanolide","C6H10O2","C01880","4993"
"D-Fructose","C6H12O6","C10906","13089"
"Cloransulam-methyl","C15H13ClFN5O5S","C10907","13090"
"Fluthiacet methyl","C15H15ClFN3O3S2","C10908","13091"
"Methabenzthiazuron","C10H11N3OS","C10909","13092"
"2-Methylthiobenzothiazole","C8H7NS2","C10910","13093"
"Bromacil","C9H13BrN2O2","C10911","13094"
"Buprofezin","C16H23N3OS","C10912","13095"
"Cycloxydim","C17H27NO3S","C10913","13096"
"Veratraldehyde","C9H10O3","C02201","5269"
"7-Oxosteroid","C19H30O","C01881","4994"
"N-Acetyl-leu-leu-leu-leu-leu-tyr-amide","C41H69N7O8","C11607","13772"
"alpha-D-Lyxose","C5H10O5","C02204","5272"
"Selenohomocysteine","C4H9NO2Se","C05698","8005"
"O-Succinylhomoserine","C8H13NO6","C05701","8008"
"O-Acetylhomoserine","C6H11NO4","C05700","8007"
"Selenocystine","C6H12N2O4Se2","C05704","8011"
"Methaneselenol","CH4Se","C05703","8010"
"Se-Propenylselenocysteine se-oxide","C6H11NO3Se","C05706","8013"
"Selenocysteine selenate","C3H7NO4Se","C05705","8012"
"Selenomethionine se-oxide","C5H11NO3Se","C05708","8015"
"Selenohomocystine","C8H16N2O4Se2","C05707","8014"
"Karwinaphthol B","C17H20O4","C09942","12128"
"11-Undecanolactone","C11H20O2","C13823","854068"
"O-Methyllycorenine","C19H25NO4","C12241","14386"
"1-Hexadecyl hexadecanoate","C32H64O2","C13821","854066"
"3-Buten-1-amine","C4H9N","C12244","14389"
"(+/-)-gamma-Lycorane","C16H19NO2","C12243","14388"
"Papyramine","C18H23NO4","C12238","14383"
"Acriflavine","C27H25ClN6","C11273","13450"
"Dextromethorphan","C18H25NO","C06947","9162"
"Diazepam","C16H13ClN2O","C06948","9163"
"Diazoxide","C8H7ClN2O2S","C06949","9164"
"Dicloxacillin","C19H17Cl2N3O5S","C06950","9165"
"Desipramine","C18H22N2","C06943","9158"
"Desmopressin","C46H64N14O12S2","C06944","9159"
"Dexamethasone","C22H29FO5","C06945","9160"
"Dexchlorpheniramine","C16H19ClN2","C06946","9161"
"Clorobiocin","C35H37ClN2O11","C12032","14187"
"(E)-2-Butenyl-4-methyl-threonine","C9H17NO3","C12029","14185"
"Dicyclomine","C19H35NO2","C06951","9166"
"Didanosine","C10H12N4O3","C06953","9168"
"Dubiusine","C23H27NO8","C12240","14385"
"Phosphoramide mustard","C4H11Cl2N2O2P","C07647","9849"
"Cholestane-3,7,12,23,25-pentol","C27H48O5","",""
"Glucosylgalactosyl hydroxylysine","C18H34N2O13","","698833"
"Dioleoylphosphatidylethanolamine","C41H78NO8P","","685590"
"Docosanamide","C40H79NO3","",""
"Coproporphyrin","C36H38N4O8","","684879"
"Glutamylphenylalanine","C14H18N2O5","","288743"
"Glucosamine 6-sulfate","C6H13NO8S","","214626"
"Glutarylglycine","C7H11NO5","",""
"Coprocholic acid","C27H46O5","","379489"
"Ganglioside GA1","C62H114N2O23","","3887981"
"Isosorbide mononitrate","C6H9NO6","C07714","9916"
"Carboxyphosphamide","C7H15Cl2N2O4P","C07646","9848"
"Agavoside A","C33H52O9","C08885","11078"
"Aldophosphamide","C7H15Cl2N2O3P","C07645","9847"
"Tolmetin","C15H15NO3","C07149","9358"
"Sobuzoxane","C22H34N4O10","C12850","583239"
"Thiamphenicol","C12H15Cl2NO5S","C12853","583242"
"Acetylpheneturide","C13H16N2O3","C12855","583244"
"Estradiol valerate","C23H32O3","C12859","583248"
"Methyl parahydroxybenzoate","C8H8O3","C12846","583235"
"Cefpirome sulfate","C22H24N6O9S3","C12847","583236"
"Betamethasone acetate","C24H31FO6","C12848","583237"
"p-Phenolsulfonic acid","C6H6O4S","C12849","583238"
"Ethylestrenol","C20H32O","C12860","583249"
"Nedaplatin","C2H8N2O3Pt","C12862","583251"
"Pseudouridine 5'-phosphate","C9H13N2O9P","C01168","4395"
"L-Glutamate 5-semialdehyde","C5H9NO3","C01165","4392"
"(R)-2-Methyl-3-oxopropanoyl-CoA","C25H40N7O19P3S","C01213","4435"
"UDP-N-acetylmuramoyl-L-alanine","C23H36N4O20P2","C01212","4434"
"Procollagen 5-hydroxy-L-lysine","C6H14N2O3","C01211","4433"
"N-Methylethanolamine phosphate","C3H10NO4P","C01210","4432"
"Cholesta-5,7-dien-3beta-ol","C27H44O","C01164","4391"
"(R)-3-Amino-2-methylpropanoate","C4H9NO2","C01205","4429"
"myo-Inositol hexakisphosphate","C6H18O24P6","C01204","4428"
"N(omega)-(ADP-D-ribosyl)-L-arginine","C21H35N9O15P2","C01201","4426"
"3-(2-Hydroxyphenyl)propanoate","C9H10O3","C01198","4423"
"3,4-Dihydroxy-trans-cinnamate","C9H8O4","C01197","4422"
"Thienamycin","C11H16N2O4S","C06664","8889"
"Zaluzanin C","C15H18O3","C09606","11797"
"Ononin","C22H22O9","C10509","12692"
"Orobol","C15H10O6","C10510","12693"
"Osajin","C25H24O5","C10511","12694"
"Kolaflavanone","C31H24O12","C09761","11949"
"Liquiritigenin","C15H12O4","C09762","11950"
"Isouvaretin","C23H22O5","C09759","11947"
"Pachyrrhizone","C20H14O7","C10512","12695"
"Agnuside","C22H26O11","C09765","11953"
"Allamandin","C15H16O7","C09766","11954"
"Manniflavanone","C30H22O13","C09763","11951"
"6-Methoxyaromadendrin 3-O-acetate","C18H16O8","C09764","11952"
"(R)-4-Methoxydalbergione","C16H14O3","C10505","12688"
"Amarogentin","C29H30O13","C09767","11955"
"Antirrhinoside","C15H22O10","C09768","11956"
"YC-17","C25H43NO6","C11994","14155"
"Millettone","C22H18O6","C10506","12689"
"10-Formyltetrahydrofolate","C20H23N7O7","C00234","3533"
"4-Methyl-2-oxopentanoate","C6H10O3","C00233","3532"
"3-Phospho-D-glyceroyl phosphate","C3H8O10P2","C00236","3535"
"Cefuroxime","C16H16N4O8S","C06894","9111"
"Guanine","C5H5N5O","C00242","3541"
"dCMP","C9H14N3O7P","C00239","3538"
"Taurine","C2H7NO3S","C00245","3544"
"Lactose","C12H22O11","C00243","3542"
"L-Sorbose","C6H12O6","C00247","3546"
"Butanoic acid","C4H8O2","C00246","3545"
"(-)-Nissolin","C16H14O5","C10508","12691"
"Ibufenac","C12H16O2","C13461","586200"
"Moracin A","C16H14O5","C08844","11037"
"Adonitoxin","C29H42O10","C08843","11036"
"Mulberrofuran A","C25H28O4","C08846","11039"
"Adynerin","C30H44O7","C08845","11038"
"Antioside","C29H44O10","C08848","11041"
"alpha-Antiarin","C29H42O11","C08847","11040"
"Aspecioside","C29H42O10","C08850","11043"
"Asclepin","C31H42O10","C08849","11042"
"Bryophyllin A","C26H32O8","C08852","11045"
"Bipindoside","C30H46O10","C08851","11044"
"Megalomicin C2","C49H86N2O17","C11988","14149"
"8,8a-Deoxyoleandolide","C20H36O6","C11989","14150"
"Megalomicin B","C46H82N2O16","C11986","14147"
"Megalomicin C1","C48H84N2O17","C11987","14148"
"2-Oxopropyl-CoM","C5H10O4S2","C11497","13667"
"L-Oleandrosyl-oleandolide","C27H46O10","C11992","14153"
"(R)-2-Hydroxypropyl-CoM","C5H12O4S2","C11496","13666"
"10-Deoxymethynolide","C17H28O4","C11993","14154"
"Methyl 6-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)-m-toluate","C16H20N2O3","C11495","13665"
"Z-Arg-Arg","C20H32N8O5","C01631","4781"
"Oleandolide","C20H34O7","C11990","14151"
"Methyl 2-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)-p-toluate","C16H20N2O3","C11494","13664"
"L-Olivosyl-oleandolide","C26H44O10","C11991","14152"
"Eleutherin","C16H16O4","C10340","12526"
"2-AminoAMP","C10H15N6O6P","C01655","4804"
"Ac-Tyr-OEt","C13H17NO4","C01657","4806"
"Acrylamide","C3H5NO","C01659","4808"
"beta-Cadinene","C15H24","C09625","11815"
"Canellal","C15H20O3","C09626","11816"
"Buddledin A","C17H24O3","C09623","11813"
"Rodiasine","C38H42N2O6","C09624","11814"
"(-)-alpha-Bisabolol","C15H26O","C09621","11811"
"Botrydial","C17H26O5","C09622","11812"
"Davidigenin","C15H14O4","C09618","11809"
"Rhoeadine","C21H21NO6","C09619","11810"
"Butrin","C27H32O15","C09616","11807"
"Catechin 7-O-beta-D-xyloside","C20H22O10","C09617","11808"
"Cartap","C7H15N3O2S2","C11080","13262"
"Pirimicarb","C11H18N4O2","C11079","13261"
"Fenoxycarb","C17H19NO4","C11078","13260"
"Diethofencarb","C14H21NO4","C11077","13259"
"Fenothiocarb sulfoxide","C13H19NO3S","C11085","13267"
"Fenothiocarb","C13H19NO2S","C11084","13266"
"2-N-Undecyltetrahydrothiophene","C15H30S","C11082","13264"
"EPTC","C9H19NOS","C11081","13263"
"Orbencarb","C12H16ClNOS","C11087","13269"
"Molinate","C9H17NOS","C11086","13268"
"Denudatin B","C21H24O5","C10554","12737"
"4'-Demethylpodophyllotoxin","C21H20O8","C10553","12736"
"5'-Phosphoribosylglycinamide","C7H15N2O8P","C03838","6578"
"4-Methylumbelliferyl acetate","C12H10O4","C03837","6577"
"3beta-Hydroxy-delta5-steroid","C19H30O","C03836","6576"
"3-Mercapto-2-mercaptomethylpropanoate","C4H8O2S2","C04371","7013"
"3-Amino-3-(4-hydroxyphenyl)propanoate","C9H11NO3","C04368","7012"
"3-(3,5-Diiodo-4-hydroxyphenyl)lactate","C9H8I2O4","C04367","7011"
"3-(2-Carboxyethenyl)-cis,cis-muconate","C9H8O6","C04366","7010"
"1-O,2-O,6-O-Trigalloyl-beta-D-glucose","C27H24O18","C04360","7006"
"1-Deoxy-D-altro-heptulose 7-phosphate","C7H15O9P","C04359","7005"
"1-(3,4-Dimethylphenyl)ethane-1,2-diol","C10H14O2","C04355","7004"
"1,2-beta-D-Glucuronosyl-D-glucuronate","C12H18O13","C04354","7003"
"5alpha-Cholest-8-en-3beta-ol","C27H46O","C03845","6582"
"5'-Phosphoribosyl-N-formylglycinamide","C8H15N2O9P","C04376","7017"
"3alpha-Hydroxy-5beta-androstan-17-one","C19H30O2","C04373","7015"
"2-Ethyl-1,3-hexanediol","C8H18O2","C14271","150259"
"11-O-Demethylpradinone I","C24H16O10","C06775","8995"
"11-O-Demethylpradimicinone I","C27H21NO11","C06776","8996"
"5-exo-Hydroxy-1,2-campholide","C10H16O3","C03843","6580"
"Vibriobactin","C35H39N5O11","C06769","8989"
"Actinomycin D","C62H86N12O16","C06770","8990"
"Flavomycin","C69H107N4O35P","C06765","8985"
"Hemine","C34H32ClFeN4O4","C06767","8987"
"11-O-Demethylpradinone II","C24H16O11","C06773","8993"
"11-O-Demethyl-7-methoxypradinone II","C25H18O11","C06774","8994"
"Triethanolamine","C6H15NO3","C06771","8991"
"Diethanolamine","C4H11NO2","C06772","8992"
"Tulipinolide","C17H22O4","C09564","11755"
"Laurifine","C19H23NO3","C09565","11756"
"6F-alpha-D-Galactosylsucrose","C18H32O16","C03848","6585"
"Acrovestone","C32H42O8","C09916","12102"
"Adriamycin","C27H29NO11","C01661","4809"
"Lasiocarpine","C21H33NO7","C10341","12527"
"Enicoflavine","C10H13NO4","C09946","12132"
"Acetylblasticidin S","C19H28N8O6","C02808","5758"
"TRAM-3","C19H15ClO","C13785","854030"
"TRAM-34","C22H17ClN2","C13784","854029"
"E-4031","C21H27N3O3S","C13776","854021"
"1,1-Diethyl-2-hydroxy-2-nitrosohydrazine","C4H10N3O2-","C13773","854019"
"HMR1556","C15H20N2O4S","C13778","854023"
"Azimilide","C23H28ClN5O3","C13777","854022"
"Linopirdine","C26H21N3O","C13780","854025"
"XE991","C26H20N2O","C13779","854024"
"UCL 1684","C34H30N4+2","C13783","854028"
"Paxilline","C27H33NO4","C13782","854027"
"1,5-Anhydro-D-fructose","C6H8O6","C06485","8716"
"(6R)-6-(L-erythro-1,2-Dihydroxypropyl)-5,6,7,8-tetrahydro-4a-hydroxypterin","C9H14N4O3","C06486","8717"
"Abequose","C6H12O4","C06471","8703"
"L-Iduronic acid","C6H10O7","C06472","8704"
"2-Keto-D-gluconic acid","C6H10O7","C06473","8705"
"3,6-Anhydrogalactopyranose","C6H10O5","C06474","8706"
"Prostaglandin F1alpha","C20H36O5","C06475","8707"
"Prostaglandin F3alpha","C20H32O5","C06476","8708"
"L-Guluronic acid","C6H10O7","C06477","8709"
"3,6-Anhydro-D-glucopyranose","C6H10O5","C06478","8710"
"6-(3,3-Dimethylallyl)chrysin","C20H18O4","C11324","13499"
"4,5-Dihydroxynaphthalene-2,7-disulfonic acid","C10H8O8S2","C11323","13498"
"4,5,6,7-Tetrachloro-2-trifluoromethylbenzimidazole","C8HCl4F3N2","C11322","13497"
"3-((3-Cholamidopropyl)dimethylammonium)-1-propanesulfonate","C32H58N2O7S","C11321","13496"
"D-Ornithine hydrochloride","C5H13ClN2O2","C11320","13495"
"3,5-Dinitrosalicylic acid","C7H4N2O7","C11319","13494"
"(D-Ala(2)-mephe(4)-gly-ol(5))enkephalin","C26H35N5O6","C11318","13493"
"3-Hydroxypimeloyl-CoA","C28H46N7O20P3S","C06714","8938"
"Dihydrophloroglucinol","C6H8O3","C06719","8942"
"8-Anilino-1-naphthalene sulfonic acid","C16H13NO3S","C11326","13501"
"8-(3,3-Dimethylallyl)chrysin","C20H18O4","C11325","13500"
"Urdamycin B","C37H44O13","C12406","582796"
"104-2","C25H24O9","C12407","582797"
"DU 122290","C19H26N2O3S","C11709","13874"
"Devazepide","C25H20N4O2","C11710","13875"
"2-Methylbenzyl alcohol","C8H10O","C07213","9422"
"o-Xylene","C8H10","C07212","9421"
"19-Hydroxy-8-O-methyltetrangulol","C20H14O5","C12400","582790"
"PD116740","C20H16O7","C12401","582791"
"Pronethalol","C15H19NO","C11707","13872"
"Sultopride","C17H26N2O4S","C11708","13873"
"Urdamycinone B","C25H24O8","C12404","582794"
"100-1","C31H34O10","C12405","582795"
"Rabelomycin","C19H14O6","C12402","582792"
"104-1","C25H24O9","C12403","582793"
"Tenatoprazole","C16H18N4O3S","C13396","586138"
"Soblidotin","C39H67N5O6","C13395","586137"
"Riboflavin butyrate","C33H44N4O10","C13386","586130"
"Iodoform","CHI3","C13383","586127"
"Azulene","C10H8","C13392","586134"
"Piracetam","C6H10N2O2","C13387","586131"
"alpha,beta-Dihydroxyethyl-TPP","C14H22N4O9P2S","C13378","586122"
"Cefpiramide sodium","C25H23N8NaO7S2","C13376","586120"
"Nilvadipine","C19H19N3O6","C13381","586125"
"Fludarabine phosphate","C10H13FN5O7P","C13380","586124"
"Peganine","C11H12N2O","C10733","12916"
"Pteleatine","C16H20NO4+","C10734","12917"
"D-Mannonate","C6H12O7","C00514","3797"
"D-Ornithine","C5H12N2O2","C00515","3798"
"Oleoyl-CoA","C39H68N7O17P3S","C00510","3793"
"Propenoate","C3H4O2","C00511","3794"
"S-Benzoate coenzyme A","C28H40N7O17P3S","C00512","3795"
"CDPglycerol","C12H21N3O13P2","C00513","3796"
"L-Cysteate","C3H7NO5S","C00506","3789"
"L-Rhamnose","C6H12O5","C00507","3790"
"L-Ribulose","C5H10O5","C00508","3791"
"Naringenin","C15H12O5","C00509","3792"
"Gibberellin A36","C20H26O6","C11862","14024"
"Gibberellin A9","C19H24O4","C11863","14025"
"threo-3-Hydroxy-L-aspartate","C4H7NO5","C11511","13681"
"2-Hydroxyglutarate","C5H8O5","C02630","5610"
"Gibberellin A51-catabolite","C19H22O5","C11854","14016"
"Gibberellin A29-catabolite","C19H22O6","C11855","14017"
"Gibberellin A6","C19H22O6","C11856","14018"
"Gibberellin A12","C20H28O4","C11857","14019"
"Gibberellin A14","C20H28O5","C11858","14020"
"Gibberellin A37 open lactone","C20H28O6","C11859","14021"
"Gibberellin A15 open lactone","C20H28O5","C11860","14022"
"Gibberellin A24","C20H26O5","C11861","14023"
"2-Methylpropanoate","C4H8O2","C02632","5612"
"13-Hydroxylupanine","C15H24N2O2","C02621","5604"
"2,3-Dimethylmalate","C6H10O5","C02624","5606"
"Pyridoxamine phosphate","C8H13N2O5P","C00647","3919"
"Retronecine","C8H13NO2","C06177","8428"
"2,4.6-Trichloroanisole","C7H5Cl3O","C11510","13680"
"2,4-Dichlorophenol","C6H4Cl2O","C02625","5607"
"Nicotinamide D-ribonucleotide","C11H15N2O8P","C00455","3741"
"2-Deoxystreptamine","C6H14N2O3","C02627","5608"
"D-Mannitol 1-phosphate","C6H15O9P","C00644","3917"
"3-Oxopropionyl-CoA","C24H38N7O18P3S","C05989","8265"
"N-Acetyl-D-mannosamine","C8H15NO6","C00645","3918"
"Xanthosine 5'-phosphate","C10H13N4O9P","C00655","3925"
"Huperzine B","C16H20N2O","C09866","12052"
"2-Aceto-2-hydroxybutanoate","C6H10O4","C00659","3928"
"Purine","C5H4N4","C00465","3749"
"Acetoin","C4H8O2","C00466","3750"
"Ethanol","C2H6O","C00469","3752"
"Gibberellin A1","C19H24O6","C00859","4116"
"L-Histidinol","C6H11N3O","C00860","4117"
"Coronopilin","C15H20O4","C09381","11572"
"Ethyl acetate","C4H8O2","C00849","4106"
"Chitodextrin","C16H28N2O11","C00851","4108"
"Chlorogenate","C16H18O9","C00852","4109"
"Cob(I)alamin","C62H88CoN13O14P","C00853","4110"
"Cyclohexanol","C6H12O","C00854","4111"
"D-Methionine","C5H11NO2S","C00855","4112"
"Deamino-NAD+","C21H26N6O15P2","C00857","4114"
"Formononetin","C16H12O4","C00858","4115"
"L-2,3-Dihydrodipicolinate","C7H7NO4","C03340","6183"
"1-Piperazineethanesulfonic acid, 4-(2-hydroxyethyl)-","C8H18N2O4S","","166367"
"D-Citrulline","C6H13N3O3","",""
"2,3-Bisphosphoglycerate","C3H8O10P2","C03339","6182"
"Methyl-N-acetylglucosamine","C9H17NO6","","673727"
"GABA methyl ester","C5H11NO2","","161621"
"1-ARGININE GLUTAMATE","C11H23N5O6","","163138"
"Diethyl oxalacetate","C8H12O5","","209052"
"17-alpha-Hydroxysteroid","C19H32O2","C03336","6180"
"Leukotriene C4","C30H47N3O9S","C02166","5241"
"Leukotriene B4","C20H32O4","C02165","5240"
"Isopimpinellin","C13H10O5","C02162","5238"
"Isophenoxazine","C12H8N2O2","C02161","5237"
"Isomaltotriose","C18H32O16","C02160","5236"
"Hydroxysteroid","C19H32O2","C02159","5235"
"Glycyl-leucine","C8H16N2O3","C02155","5232"
"Glyceraldehyde","C3H6O3","C02154","5231"
"Glucotropeolin","C14H18NO9S2-","C02153","5230"
"Geissoschizine","C21H24N2O3","C02151","5228"
"Orinapterin","C9H11N5O3","",""
"Swertiajaponin","C22H22O11","C10187","12373"
"Pravastatin","C23H36O7","C01844","4962"
"Pentanamide","C5H11NO","C01842","4960"
"Pentalenene","C15H24","C01841","4959"
"Orsellinate","C8H8O4","C01839","4958"
"Rifamycin O","C39H47NO14","C01849","4966"
"Rifamycin B","C39H49NO14","C01848","4965"
"Reduced FMN","C17H23N4O9P","C01847","4964"
"Propan-2-ol","C3H8O","C01845","4963"
"Scopolamine","C17H21NO4","C01851","4968"
"Rosmarinate","C18H16O8","C01850","4967"
"Capryloylglycine","C10H19NO3","","661193"
"Inositol hexanicotinate","C42H30N6O12","C13283","586027"
"Peucedanin","C15H14O4","C09283","11474"
"Peucenidin","C21H22O7","C09284","11475"
"O-beta-D-Xylosylzeatin","C15H21N5O5","C03300","6156"
"O-Decanoyl-L-carnitine","C18H36NO3+","C03299","6155"
"Tambulin","C18H16O7","C10189","12375"
"Mammeisin","C25H26O5","C09275","11466"
"Marmesin","C14H14O4","C09276","11467"
"Micromelin","C15H12O6","C09277","11468"
"Nodakenetin","C14H14O4","C09278","11469"
"Nodakenin","C20H24O9","C09279","11470"
"Osthol","C15H16O3","C09280","11471"
"Ostruthin","C19H22O3","C09281","11472"
"Oxypeucedanin","C16H14O5","C09282","11473"
"Plaunotol","C20H34O2","C13273","586017"
"N-Hydroxy-2-acetamidofluorene","C15H13NO2","C03954","6675"
"N6-Acetyl-N6-hydroxy-L-lysine","C8H16N2O4","C03955","6676"
"Sciadopitysin","C33H24O10","C10182","12368"
"N-Acetylglucosamine 4-sulfate","C8H15NO9S","C03953","6674"
"Chaksine","C22H38N6O4","C09940","12126"
"Strobopinin","C16H14O4","C09939","12125"
"Thyrotropin releasing hormone","C16H22N6O4","C03958","6679"
"erythro-3-Hydroxy-L-aspartate","C4H7NO5","C03961","6682"
"Humulene","C15H24","C09684","11874"
"Hirsutic acid C","C15H20O4","C09683","11873"
"Himachalol","C15H26O","C09682","11872"
"Hernandulcin","C15H24O2","C09681","11871"
"Hemigossypol","C15H16O4","C09680","11870"
"Helminthosporoside A","C39H64O22","C09679","11869"
"Helminthosporol","C15H24O2","C09678","11868"
"Helminthosporal","C15H22O2","C09677","11867"
"Diospyrin","C22H14O6","C10332","12518"
"Isatidine","C18H25NO7","C10333","12519"
"Dothistromin","C18H12O9","C10334","12520"
"Droserone","C11H8O4","C10335","12521"
"Isolycopsamine","C15H25NO5","C10336","12522"
"Dunnione","C15H14O3","C10337","12523"
"Wuweizisu C","C22H24O6","C10893","13076"
"Yangambin","C24H30O8","C10894","13077"
"Trachelogenin","C21H24O7","C10891","13074"
"(+)-Veraguensin","C22H28O5","C10892","13075"
"(+)-Syringaresinol","C22H26O8","C10889","13072"
"(+)-Syringaresinol O-beta-D-glucoside","C28H36O13","C10890","13073"
"Styraxin","C20H18O7","C10887","13070"
"Surinamensin","C22H28O6","C10888","13071"
"Simplexoside","C26H30O11","C10885","13068"
"Steganacin","C24H24O9","C10886","13069"
"Scullcapflavone II","C19H18O8","C10183","12369"
"dTDP-3-methyl-4-oxo-2,6-dideoxy-L-glucose","C17H26N2O14P2","C11915","14076"
"Esmeraldic acid","C30H22N4O5","C12116","14263"
"6-Acetamido-3-oxohexanoate","C8H13NO4","C03682","6457"
"6-Demethylsterigmatocystin","C17H10O6","C03683","6458"
"4-Imidazolone-5-propanoate","C6H8N2O3","C03680","6455"
"5alpha-Pregnane-3,20-dione","C21H32O2","C03681","6456"
"4-Amino-3-hydroxybutanoate","C4H9NO3","C03678","6453"
"4-Chlorophenylacetonitrile","C8H6ClN","C03679","6454"
"3-Hydroxy-cis,cis-muconate","C6H6O5","C03676","6451"
"4,21-Dehydrogeissoschizine","C21H23N2O3+","C03677","6452"
"6-Pyruvoyltetrahydropterin","C9H11N5O3","C03684","6459"
"7-Methyl-3-oxooctanoyl-CoA","C30H50N7O18P3S","C03685","6460"
"3-Methyldioxyindole","C9H9NO2","C05834","8127"
"5-Hydroxyindoleacetylglycine","C12H12N2O4","C05832","8126"
"3-Methoxyanthranilate","C8H9NO3","C05831","8125"
"8-Methoxykynurenate","C11H9NO4","C05830","8124"
"N-Carbamyl-L-glutamate","C6H10N2O5","C05829","8123"
"Methylimidazoleacetic acid","C6H8N2O2","C05828","8122"
"Methylimidazole acetaldehyde","C6H8N2O","C05827","8121"
"2-Amino-5-oxohexanoate","C6H11NO3","C05825","8120"
"Sexangularetin","C16H12O7","C10185","12371"
"Indole-3-acetaldoxime","C10H10N2O","C05836","8129"
"2-Formaminobenzoylacetate","C10H9NO4","C05835","8128"
"7-Chloroemodin","C15H9ClO5","C10311","12497"
"Chimaphylin","C12H10O2","C10310","12496"
"Barbaloin","C21H22O9","C10305","12491"
"Fulvine","C16H23NO5","C10304","12490"
"Aurantio-obtusin beta-D-glucoside","C23H24O12","C10303","12489"
"Arnebinone","C18H22O4","C10302","12488"
"Cercosporin","C29H26O10","C10309","12495"
"Cassiamin C","C30H18O8","C10308","12494"
"Cascaroside A","C27H32O14","C10307","12493"
"Bikaverin","C20H14O8","C10306","12492"
"Amodiaquine","C20H22ClN3O","C07626","9828"
"Chlorobiphenyl-vancomycin","C79H84Cl3N9O24","C12035","14190"
"Chlorobiphenyl-chloroeremomycin","C86H97Cl3N10O26","C12034","14189"
"p-Aminophenylalanine","C9H12N2O2","C12033","14188"
"Telomestatin","C26H14N8O7S","C12040","14195"
"Epothilone D","C27H41NO5S","C12039","14194"
"Abacavir","C14H18N6O","C07624","9826"
"Pyochelin","C14H16N2O3S2","C12037","14192"
"Fengycin","C72H110N12O20","C12042","14197"
"Tyrocidine","C66H87N13O13","C12041","14196"
"Sulfadoxine","C12H14N4O4S","C07630","9832"
"Proguanil","C11H16ClN5","C07631","9833"
"N,N,N-Trimethylserotonin","C13H19N2O+","C13664","586257"
"Sulcatone","C8H14O","C07287","9496"
"Lacto-N-biose","C14H25NO11","C06372","8608"
"Lacto-N-tetraose","C26H45NO21","C06371","8607"
"Methyl cinnamate","C10H10O2","C06358","8594"
"2,4,6-Trihydroxybenzophenone","C13H10O4","C06356","8592"
"Propyl cinnamate","C12H14O2","C06360","8596"
"Ethyl cinnamate","C11H12O2","C06359","8595"
"1-Carboxyvinyl carboxyphosphonate","C4H5O7P","C06367","8603"
"Homospermidine","C8H21N3","C06366","8602"
"2-Deoxy-D-glucose 6-phosphate","C6H13O8P","C06369","8605"
"3-(Hydrohydroxyphosphoryl)pyruvate","C3H5O5P","C06368","8604"
"Rabeprazole sodium","C18H20N3NaO3S","C07865","10067"
"Dolasetron","C19H20N2O3","C07866","10068"
"Cromolyn","C23H16O11","C06928","9145"
"Cyclandelate","C17H24O3","C06929","9146"
"Clonidine","C9H9Cl2N3","C06920","9137"
"Clorazepate","C16H11ClN2O3","C06921","9138"
"Clomipramine","C19H23ClN2","C06918","9135"
"Clidinium","C22H26NO3+","C07853","10055"
"Clozapine","C18H19ClN4","C06924","9141"
"Cosyntropin","C136H210N40O31S","C06926","9143"
"Clotrimazole","C22H17ClN2","C06922","9139"
"Rabeprazole","C18H21N3O3S","C07864","10066"
"4-Hydroxy-2-oxoglutarate","C5H6O6","C01127","4358"
"Rugosin D","C82H58O52","C10240","12426"
"Tellimagrandin I","C34H26O22","C10241","12427"
"Mahuannin D","C30H24O9","C10234","12420"
"n-Decanohydroxamic acid","C10H21NO2","C12889","583278"
"Acetylspiramycin","C45H76N2O15","C12891","583280"
"Mallotusinic acid","C48H32O32","C10235","12421"
"Deprodone propionate","C24H32O5","C12880","583269"
"Clorexolone","C14H17ClN2O3S","C12882","583271"
"Piromidic acid","C14H16N4O3","C12877","583266"
"pi-Oxocamphor","C10H14O2","C12879","583268"
"Dialicor","C21H28ClNO2","C12886","583275"
"Hydrocortisone succinate","C25H34O8","C12888","583277"
"Nifenazone","C17H16N4O2","C12883","583272"
"Perlapine","C19H21N3","C12884","583273"
"Kandelin A-1","C39H32O15","C10233","12419"
"N1,N12-Diacetylspermine","C14H30N4O2","C03413","6242"
"Procyanidin B4","C30H26O12","C10238","12424"
"Robinetinidol-(4alpha->8)-catechin-(6->4alpha)-robinetinidol","C45H38O18","C10239","12425"
"Decanoylcarnitine","C17H33NO4","","728452"
"1,3,8-Naphthalenertriol","C10H8O3","C01173","4400"
"1L-myo-Inositol 1-phosphate","C6H13O9P","C01177","4404"
"17alpha-Hydroxyprogesterone","C21H30O3","C01176","4403"
"UDP-N-acetyl-D-mannosamine","C17H27N3O17P2","C01170","4397"
"Pedunculagin","C34H24O22","C10236","12422"
"beta-D-Glucose 6-phosphate","C6H13O9P","C01172","4399"
"N-Acetyl-D-galactosamine","C8H15NO6","C01132","4363"
"Deoxycholic acid glycine conjugate","C26H43NO5","","375907"
"Epitestosterone","C19H28O2","","153448"
"S-Adenosylmethioninamine","C14H23N6O3S+","C01137","4368"
"(6aR,11aR)-3,9-Dihydroxypterocarpan","C15H12O4","C04271","6934"
"4-Methylthio-2-oxobutanoic acid","C5H8O3S","C01180","4407"
"3-(4-Hydroxyphenyl)pyruvate","C9H8O4","C01179","4406"
"Coproporphyrin IV","C36H38N4O8","","745167"
"Erythronilic acid","C5H10O3","","208820"
"Rubrofusarin","C15H12O5","C09047","11239"
"Bleekerine","C23H24N2O5","C09046","11238"
"Baloxine","C21H24N2O4","C09045","11237"
"Quinquangulin","C16H14O5","C09044","11236"
"Borrecapine","C20H24N2O","C09051","11243"
"Bonafousine","C35H40N4O3","C09050","11242"
"Visnagin","C13H10O4","C09049","11241"
"Spathelia bischromene","C20H20O4","C09048","11240"
"Glucoerucin","C12H22NO9S3-","C08409","10605"
"Glucoconringiin","C11H20NO10S2-","C08408","10604"
"Alloimperatorin","C16H14O4","C09053","11245"
"Borreline","C17H18N2O","C09052","11244"
"O-beta-D-Glucosylzeatin","C16H23N5O6","C03423","6250"
"Glycolate","C2H4O3","C00160","3460"
"D-Mannose","C6H12O6","C00159","3459"
"Citrate","C6H8O7","C00158","3458"
"4-Hydroxybenzoate","C7H6O3","C00156","3456"
"L-Homocysteine","C4H9NO2S","C00155","3455"
"Palmitoyl-CoA","C37H66N7O17P3S","C00154","3454"
"Nicotinamide","C6H6N2O","C00153","3453"
"L-Asparagine","C4H8N2O3","C00152","3452"
"Acetoacetate","C4H6O3","C00164","3464"
"Propanoate","C3H6O2","C00163","3463"
"Labriformidin","C29H36O11","C08870","11063"
"Helveticoside","C29H42O9","C08869","11062"
"Hellebrin","C36H52O15","C08868","11061"
"Hellebrigenin 3-acetate","C26H34O7","C08867","11060"
"Gitoxin","C41H64O14","C08866","11059"
"Eriocarpin","C29H38O11","C08865","11058"
"Divostroside","C30H46O8","C08864","11057"
"Divaricoside","C30H46O8","C08863","11056"
"Lanceotoxin A","C32H44O12","C08872","11065"
"Labriformin","C31H39NO10S","C08871","11064"
"Apohyoscine","C17H19NO3","C10844","13027"
"Apoatropine","C17H21NO2","C10843","13026"
"Seneciphylline","C18H23NO5","C10391","12577"
"Primin","C12H16O3","C10390","12576"
"Zinniol","C15H22O4","C10840","13023"
"Urushiol III","C21H32O2","C10839","13022"
"Plumbagin","C11H8O3","C10387","12573"
"3-beta-D-Glucopyranuronosyloxy-5-methylisoxazole","C10H13NO8","C11107","13289"
"Bucillamine","C7H13NO3S2","C13279","586023"
"Anatoxin a","C10H15NO","C10841","13024"
"Nicorandil","C8H9N3O4","C13280","586024"
"Fipronil","C12H4Cl2F6N4OS","C11099","13281"
"Fenpyroximate","C24H27N3O4","C11098","13280"
"5-Hydroxymethyl-2-furaldehyde","C6H6O3","C11101","13283"
"Flurochloridone","C12H10Cl2F3NO","C11100","13282"
"Hymexazol","C4H5NO2","C11103","13285"
"Salicylamide","C7H7NO2","C13281","586025"
"5-Methyl-3-isoxazolyl sulfate","C4H5NO5S","C11105","13287"
"Hymexazol N-glucoside","C10H15NO7","C11104","13286"
"Mesembrine","C17H23NO3","C09224","11415"
"Mesembrenone","C17H21NO3","C09223","11414"
"Cefovecin sodium","C17H18N5NaO6S2","C13142","585206"
"Turricolol E","C21H30O3","C10838","13021"
"Daphnoretin","C19H12O7","C09216","11407"
"Ibogamine","C19H24N2","C09215","11406"
"Leurosidine","C46H58N4O9","C09218","11409"
"Isoajmaline","C20H26N2O2","C09217","11408"
"Mahanimbine","C23H25NO","C09220","11411"
"Leurosine","C46H56N4O9","C09219","11410"
"Melosatin B","C19H19NO2","C09222","11413"
"Melosatin A","C21H23NO4","C09221","11412"
"Artemisin","C15H18O4","C09344","11535"
"Artemorin","C15H20O3","C09345","11536"
"Presqualene diphosphate","C30H52O7P2","C03428","6255"
"Prephytoene diphosphate","C40H68O7P2","C03427","6254"
"Bis-D-fructose 2',1:2,1'-dianhydride","C12H20O10","C04333","6984"
"Aceglatone","C10H10O8","C13275","586019"
"3-Amino-4-hydroxybenzoic acid","C7H7NO3","C12115","14262"
"N6,N6-Dimethyladenosine","C12H17N5O4","C03416","6245"
"N2-Succinyl-L-ornithine","C9H16N2O5","C03415","6244"
"N2-Malonyl-D-tryptophan","C14H14N2O5","C03414","6243"
"Mebutamate","C10H20N2O4","C13277","586021"
"Oleic acid methyl ester","C19H36O2","C03425","6252"
"(-)-Argemonine","C21H25NO4","C09341","11532"
"Armepavine","C19H23NO3","C09342","11533"
"Ngamma-Nitro-L-arginine","C6H13N5O4","C03417","6246"
"Valiolone","C7H12O6","C12113","14260"
"Saphenic acid methyl ester","C16H14N2O3","C12118","14265"
"HLo7","C15H17I2N5O4","C07596","9798"
"Theasaponin","C59H92O27","C08986","11178"
"D-Mannosamine","C6H13NO5","C03570","6362"
"dTDP-3-amino-2,3,6-trideoxy-D-threo-hexopyranos-4-ulose","C16H25N3O13P2","C12318","582708"
"Theogallin","C14H16O10","C10834","13017"
"Syringic acid","C9H10O5","C10833","13016"
"Sesamol","C7H6O3","C10832","13015"
"Zygadenine","C27H43NO7","C10831","13014"
"Verticine","C27H45NO3","C10830","13013"
"Saphenic acid","C15H12N2O3","C12117","14264"
"Veracevine","C27H43NO8","C10828","13011"
"Tomatine","C50H83NO21","C10827","13010"
"Tomatidine","C27H45NO2","C10826","13009"
"Terminaline","C23H41NO2","C10825","13008"
"Levonorgestrel","C21H28O2","C08149","10349"
"Styrene oxide","C8H8O","C02083","5168"
"2,3-Diaminopropanoate","C3H8N2O2","C06393","8629"
"beta-D-Fucose","C6H12O5","C02095","5179"
"6-Acetophenazine-1-carboxylic acid","C15H10N2O3","C12120","14267"
"beta-Carotene","C40H56","C02094","5178"
"Butanal","C4H8O","C01412","4600"
"5-Deoxy-5-aminoshikimic acid","C7H11NO4","C12121","14268"
"Ureidoglycine","C3H7N3O3","C02091","5176"
"ADP-L-glycero-D-manno-heptose","C17H27N5O16P2","C06398","8634"
"Virgaureasaponin I","C59H96O27","C08989","11181"
"Hydrogenobyrinate","C45H60N4O14","C06399","8635"
"(+)-delta-Cadinene","C15H24","C06394","8630"
"ADP-D-glycero-D-manno-heptose","C17H27N5O16P2","C06397","8633"
"Tremetone","C13H14O2","C08992","11184"
"beta-D-Xylose","C5H10O5","C02096","5180"
"2,5-Diaminopyrimidine nucleoside triphosphate","C9H18N5O14P3","C05923","8211"
"Cocaine","C17H21NO4","C01416","4603"
"Wogonin","C16H12O5","C10197","12383"
"Cefotetan disodium","C17H15N7Na2O8S4","C14007","854248"
"Cefazolin sodium hydrate","C14H23N8NaO9S3","C14005","854246"
"YC 170","C28H26ClN3O3","C13760","586346"
"FPL64176","C22H21NO3","C13759","586345"
"Sulbactam sodium","C8H10NNaO5S","C14001","854242"
"Ciprofloxacin hydrochloride","C17H21ClFN3O4","C13993","854234"
"Dicloxacillin sodium","C19H18Cl2N3NaO6S","C13756","854010"
"Lincomycin hydrochloride","C18H37ClN2O7S","C14002","854243"
"Talampicillin hydrochloride","C24H24ClN3O6S","C13978","854219"
"Carfecillin sodium","C23H21N2NaO6S","C13976","854217"
"6-Mercaptopurine","C5H6N4OS","C13992","854233"
"Hetacillin potassium","C19H22KN3O4S","C13980","854221"
"1-Phospho-alpha-D-galacturonate","C6H11O10P","C04037","6740"
"Triphenyltetrazolium chloride","C19H15ClN4","C11305","13480"
"S-(PGA1)-glutathione","C30H49N3O10S","C11304","13479"
"Phosphonoformate","CH3O5P","C06456","8689"
"Bialaphos","C11H22N3O6P","C06457","8690"
"Sulfoglycolithocholate","C26H42NO7S-","C11301","13476"
"Soraphen A","C29H44O8","C11300","13475"
"S-Decyl GSH","C20H37N3O6S","C11303","13478"
"S-Octyl GSH","C18H33N3O6S","C11302","13477"
"N-Acetyl-leu-leu-tyr-amide","C23H36N4O5","C11297","13472"
"N-Acetyl-leu-leu-leu-tyr-amide","C29H47N5O6","C11296","13471"
"Virginiamycin M1","C28H35N3O7","C11299","13474"
"N-Formyl-norleucyl-leucyl-phenylalanyl-methylester","C23H35N3O5","C11298","13473"
"(-)-Salsolinol","C10H13NO2","C09642","11832"
"(+)-Catechin","C15H14O6","C06562","8791"
"(2,3-Dihydroxybenzoyl)adenylate","C17H18N5O10P","C04030","6734"
"Ritodrine","C17H21NO3","C07239","9448"
"Plaunol B","C20H20O6","C09166","11358"
"Prednisolone acetate","C23H30O6","C08180","10380"
"Methylprednisolone acetate","C24H32O6","C08179","10379"
"Molindone","C16H24N2O2","C07230","9439"
"Raloxifene","C28H27NO4S","C07228","9437"
"Rifabutin","C46H62N4O11","C07235","9444"
"Polypodine B","C27H44O8","C08834","11027"
"Benzene","C6H6","C01407","4596"
"Aurothioglucose","C6H11AuO5S","C08193","10392"
"Sermorelin","C149H246N44O42S","C08192","10391"
"L-Arabinonate","C5H10O6","C00545","3826"
"Ergocristine","C35H39N5O5","C09164","11356"
"Laricitrin","C16H12O8","C12633","583023"
"Luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide]","C27H26O18","C12632","583022"
"Kaempferol3-O-beta-D-glucosyl-(1->2)-beta-D-glucosyl-(1->2)-beta-D-glucoside","C33H40O21","C12635","583025"
"Kaempferol 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside","C27H30O16","C12634","583024"
"7-O-Methylvitexin 2''-O-beta-L-rhamnoside","C28H32O14","C12629","583019"
"Vitexin 2''-O-beta-L-rhamnoside","C27H30O14","C12628","583018"
"2-Hydroxy-2,3-dihydrogenistein","C15H12O6","C12631","583021"
"Luteolin 7-O-neohesperidoside","C27H30O15","C12630","583020"
"N-Benzoyl-D-arginine","C13H18N4O3","C03001","5910"
"Quercetin 3-O-[beta-D-xylosyl-(1->2)-beta-D-glucoside]","C26H28O16","C12637","583027"
"Kaempferol3-O-[6-(4-coumaroyl)-beta-D-glucosyl-(1->2)-beta-D-glucosyl-(1->2)-beta-D-glucoside]","C42H46O23","C12636","583026"
"Podocarpic acid","C17H22O3","C09171","11363"
"N-Amidino-L-glutamate","C6H11N3O4","C03140","6029"
"Plaunol D","C20H22O7","C09168","11360"
"Aspirin","C9H8O4","C01405","4594"
"Pleuromutilin","C22H34O5","C09169","11361"
"N-D-Ribosylpyrimidine","C9H13N2O4+","C03143","6032"
"beta-Alaninebetaine","C6H13NO2","C08263","10462"
"Boc-Asn","C9H16N2O5","C01410","4598"
"3-Methylbutanoic acid","C5H10O2","C08262","10461"
"Azelaic acid","C9H16O4","C08261","10460"
"Desmethyldescarbamoylnovobiocin","C29H33NO10","C12475","582865"
"Diflunisal","C13H8F2O3","C01691","4832"
"(-)-Viburnitol","C6H12O5","C08259","10458"
"N-D-Glucosylarylamine","C12H17NO5","C03142","6031"
"3-Amino-4,7-dihydroxycoumarin","C9H7NO4","C12468","582858"
"Carnitine","C7H15NO3","C00487","3770"
"Formamide","CH3NO","C00488","3771"
"Tyramine","C8H11NO","C00483","3766"
"Bilirubin","C33H36N4O6","C00486","3769"
"L-Cystine","C6H12N2O4S2","C00491","3774"
"Raffinose","C18H32O16","C00492","3775"
"Glutarate","C5H8O4","C00489","3772"
"Itaconate","C5H6O4","C00490","3773"
"Shikimate","C7H10O5","C00493","3776"
"Sisomicin","C19H37N5O7","C00494","3777"
"3a,4b,7a,12a-Tetrahydroxy-5b-cholanoic acid","C24H40O6","",""
"Disulfiram","C10H20N2S4","C01692","4833"
"N-(3-(S)-Hydroxybutyryl)homoserine lactone","C8H13NO4","C11842","14004"
"2 -(Butylamido)-4-hydroxybutanoic acid","C8H15NO4","C11843","14005"
"N-(3-Oxododecanoyl)homoserine lactone","C16H27NO4","C11840","14002"
"N-(3-Oxooctanoyl)homoserine lactone","C12H19NO4","C11841","14003"
"Bacampicillin","C21H27N3O7S","C08122","10322"
"N-Acetyl-D-hexosamine","C8H15NO6","C03136","6025"
"4-Benzyloxybenzyl alcohol","C14H14O2","C11834","13998"
"N-Butyryl-L-homoserine lactone","C8H13NO3","C11837","13999"
"Divinyl chlorophyllide a","C35H32MgN4O5","C11832","13996"
"Isoclavulanic acid","C8H9NO5","C11833","13997"
"1,3,7,12-Tetrahydroxycholan-24-oic acid","C24H40O6","","771508"
"3a,7b,12a-Trihydroxy-5a-Cholanoic acid","C24H40O5","",""
"1-Stearoyl-2-palmitoylphosphatidylcholine","C42H84NO8P","",""
"3,4-Dimethoxyphenylacetic acid","C10H12O4","","337574"
"Vancomycin hydrochloride","C66H76Cl3N9O24","C08121","10321"
"N,N-Dimethylformamide","C3H7NO","C03134","6023"
"3b,7b,12a-Trihydroxy-5a-Cholanoic acid","C24H40O5","",""
"16,17-Epiestriol","C18H24O3","",""
"24,25-Dihydroxyvitamin D","C27H44O3","","254150"
"5-Amino-1-ribofuranosylimidazole-4-carboxyamide","C9H14N4O6","C04663","7247"
"N-Amidino-L-aspartate","C5H9N3O4","C03139","6028"
"Toremifene","C26H28ClNO","C08166","10366"
"3-Oxoglycyrrhetinate","C30H44O4","C02943","5862"
"Bacampicillin hydrochloride","C21H28ClN3O7S","C08123","10323"
"N-Acetyl-D-tryptophan","C13H14N2O3","C03137","6026"
"Meloxicam","C14H13N3O4S2","C08169","10369"
"Urea","CH4N2O","C00086","3386"
"3a,6b,7b,12b-Tetrahydroxy-5b-cholanoic acid","C24H40O6","",""
"2-Methylbutyroylcarnitine","C12H23NO4","",""
"2-Hydroxyestradiol-3-methylether","C19H26O3","",""
"3a-Hydroxy-5a-cholanoic acid","C24H40O3","",""
"2-Amino-3-phosphonopropionic acid","C3H8NO5P","","89428"
"1,3,12-Trihydroxycholan-24-oic acid","C24H40O5","",""
"2-Hydroxyphenylacetic acid","C9H10O3","","284627"
"3b,7a,12a-Trihydroxy-5a-Cholanoic acid","C24H40O5","",""
"3'-Deoxydihydrostreptomycin 6,3''-bis-phosphate","C21H41N7O17P2","C04660","7244"
"3a,17a-Dihydroxy-5b-androstane","C19H32O2","",""
"12a-Hydroxy-3-oxocholadienic acid","C24H34O4","","744253"
"Septentrionine","C38H54N2O11","C08706","10899"
"Songorine","C22H31NO3","C08707","10900"
"Pseudoaconitine","C36H51NO12","C08704","10897"
"Acetyl-maltose","C14H24O12","C02130","5209"
"Dodecylaldehyde","C12H24O","C02278","5336"
"1-Dodecanol","C12H26O","C02277","5335"
"Dihydrocoumarin","C9H8O2","C02274","5334"
"Spiramine A","C24H33NO4","C08709","10902"
"Glycyrrhetinate","C30H46O4","C02283","5340"
"GDP-L-galactose","C16H25N5O16P2","C02280","5337"
"L-Arginine phosphate","C6H15N4O5P","C05945","8229"
"Acetylpyruvate","C5H6O4","C02132","5211"
"Pent-2-enoyl-CoA","C26H42N7O17P3S","C02451","5471"
"10-Formyldihydrofolate","C20H21N7O7","C03204","6080"
"Paricalcitol","C27H44O3","C08127","10327"
"3-Hydroxybenzo(a)pyrene","C20H12O","C14461","168655"
"Cortisone acetate","C23H30O6","C08173","10373"
"2-Hydroxyfluorene","C13H10O","C14460","217766"
"Linezolid","C16H20FN3O4","C08146","10346"
"Dexamethasone acetate anhydrous","C24H31FO6","C08174","10374"
"Methoxamine","C11H17NO3","C07513","9716"
"Diethylstilbestrol diphosphate","C18H22O8P2","C08145","10345"
"3-cis-Dodecenoyl-CoA","C33H56N7O17P3S","C02944","5863"
"Simetryn","C8H15N5S","C14457","157226"
"4-Chloronitrobenzene","C6H4ClNO2","C14456","150546"
"L-2-Amino-4-(hydroxymethylphosphinyl)butanoate","C5H12NO4P","C04650","7238"
"Arteglasin A","C17H20O5","C09303","11494"
"Artemisiifolin","C15H20O4","C09304","11495"
"Artabsin","C15H20O3","C09301","11492"
"Artecanin","C15H18O5","C09302","11493"
"Arnicolide A","C17H22O5","C09299","11490"
"Aromaticin","C15H18O3","C09300","11491"
"Arctiopicrin","C19H26O6","C09297","11488"
"Arctolide","C17H20O6","C09298","11489"
"Arbusculin A","C15H22O3","C09295","11486"
"Archangelolide","C29H40O10","C09296","11487"
"Mukaadial","C15H22O4","C09702","11892"
"Marasmic acid","C15H18O4","C09701","11891"
"Patchouli alcohol","C15H26O","C09705","11894"
"Nerolidol","C15H26O","C09704","11893"
"Ledol","C15H26O","C09698","11888"
"Laserpitin","C25H38O7","C09697","11887"
"Lubimin","C15H24O2","C09700","11890"
"Longifolene","C15H24","C09699","11889"
"Phaseic acid","C15H20O5","C09707","11896"
"Petasin","C20H28O3","C09706","11895"
"Valeroidine","C13H23NO3","C10869","13052"
"Phyllanthostatin A","C29H30O13","C10870","13053"
"Picropodophyllin","C22H22O8","C10871","13054"
"Pinoresinol","C20H22O6","C10872","13055"
"Pseudopelletierine","C9H15NO","C10865","13048"
"Scopoline","C8H13NO2","C10866","13049"
"Strobamine","C17H19NO2","C10867","13050"
"Tigloidine","C13H21NO2","C10868","13051"
"Plicatic acid","C20H22O10","C10873","13056"
"Podophyllotoxin","C22H22O8","C10874","13057"
"2-Isoprenylemodin","C20H18O5","C10360","12546"
"Phalaenopsine T","C20H27NO5","C10361","12547"
"Thiophene-2-carbonyl-CoA","C26H38N7O17P3S2","C07347","9554"
"Vanillactic acid","C10H12O5","","738145"
"4'-Prenyloxyresveratrol","C19H20O4","C10283","12469"
"Clivoline","C21H27NO7","C10282","12468"
"4-Prenylresveratrol","C19H20O3","C10285","12471"
"Crotanecine","C8H13NO3","C10284","12470"
"Pterostilbene","C16H16O3","C10287","12473"
"Doronine","C21H30ClNO8","C10286","12472"
"epsilon-Viniferin","C28H22O6","C10289","12475"
"Rhaponticin","C21H24O9","C10288","12474"
"Alizarin 2-methyl ether","C15H10O4","C10291","12477"
"Acamelin","C10H8O4","C10290","12476"
"cis-2,3-Dihydrodiol 1,1,1-Trichloro-2,2-bis(4'-chlorophenyl)ethane","C14H11Cl5O2","C06649","8875"
"Pregnanediol","C21H36O2","C05484","7844"
"3alpha,20alpha,21-Trihydroxy-5beta-pregnane-11-one","C21H34O4","C05483","7843"
"Tetrahydrocorticosterone","C21H34O4","C05476","7836"
"11beta,21-Dihydroxy-5beta-pregnane-3,20-dione","C21H32O4","C05475","7835"
"3alpha,21-Dihydroxy-5beta-pregnane-11,20-dione","C21H32O4","C05478","7838"
"21-Hydroxy-5beta-pregnane-3,11,20-trione","C21H30O4","C05477","7837"
"3alpha-Hydroxy-5beta-pregnane-20-one","C21H34O2","C05480","7840"
"5beta-Pregnane-3,20-dione","C21H32O2","C05479","7839"
"Cortol","C21H36O5","C05482","7842"
"Cortolone","C21H34O5","C05481","7841"
"Tiamulin","C28H47NO4S","C12065","14218"
"Resorcinol monoacetate","C8H8O3","C12064","14217"
"Thiostrepton","C72H85N19O18S5","C12054","14209"
"Nosiheptide","C51H43N13O12S6","C12053","14208"
"Actinonin","C19H35N3O5","C12056","14211"
"Sulfamycin B","C54H52N16O16S2","C12055","14210"
"Cerulenin","C12H17NO3","C12058","14213"
"Cyclothialidine","C26H35N5O12S","C12057","14212"
"Naphthyl dipeptide","C25H30N4O2","C12062","14215"
"Triclosan","C12H7Cl3O2","C12059","14214"
"(13E)-(15S)-15-Hydroxy-9-oxoprosta-10,13-dienoate","C20H32O4","C04685","7266"
"(13E)-(15S)-15-Hydroxy-9-oxoprosta-11,13-dienoate","C20H32O4","C04686","7267"
"TES","C6H15NO6S","C05353","7730"
"(5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprostanoate","C20H32O5","C04671","7252"
"(9Z,15Z)-(13S)-12,13-Epoxyoctadeca-9,11,15-trienoic acid","C18H28O3","C04672","7253"
"1D-1-Guanidino-1-deoxy-3-dehydro-scyllo-inositol","C7H13N3O5","C04673","7254"
"3-D-Glucuronosyl-N2,6-disulfo-beta-D-glucosamine","C12H21NO17S2","C04674","7255"
"3-Hydroxy-3-(4-methylpent-3-en-1-yl)glutaryl-CoA","C32H52N7O19P3S","C04675","7256"
"Testololactone","C19H26O3","C04676","7257"
"1-(5'-Phosphoribosyl)-5-amino-4-imidazolecarboxamide","C9H15N4O8P","C04677","7258"
"m-Carboxyphenyl phenylacetamidomethylphosphonate","C16H16NO7P","C04684","7265"
"Succinoadenosine","C14H17N5O8","","742711"
"2-Octaprenyl-6-methoxyphenol","C47H72O2","C05812","8107"
"2-Octaprenyl-6-hydroxyphenol","C46H70O2","C05811","8106"
"2-Hexaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinone","C38H56O4","C05805","8100"
"2-Hexaprenyl-3-methyl-6-methoxy-1,4-benzoquinone","C38H56O3","C05804","8099"
"2-Octaprenylphenol","C46H70O","C05810","8105"
"3-Octaprenyl-4-hydroxybenzoate","C47H70O3","C05809","8104"
"2-Hexaprenyl-6-hydroxyphenol","C36H54O2","C05801","8096"
"2-Hexaprenylphenol","C36H54O","C05800","8095"
"2-Hexaprenyl-6-methoxy-1,4-benzoquinone","C37H54O3","C05803","8098"
"2-Hexaprenyl-6-methoxyphenol","C37H56O2","C05802","8097"
"Mephobarbital","C13H14N2O3","C07829","10031"
"Ethinamate","C9H13NO2","C07832","10034"
"Aprobarbital","C10H14N2O3","C07826","10028"
"Butabarbital","C10H16N2O3","C07827","10029"
"Dyphylline","C10H14N4O4","C07819","10021"
"Flumazenil","C15H14FN3O3","C07825","10027"
"Mometasone furoate","C27H30Cl2O6","C07817","10019"
"Mepenzolate","C21H25NO3","C07818","10020"
"Fluticasone","C22H27F3O4S","C07815","10017"
"Mometasone","C22H28Cl2O4","C07816","10018"
"D-Phenyllactic acid","C9H10O3","","688225"
"alpha-Amino-gamma-cyanobutanoate","C5H8N2O2","C05717","8023"
"O-Acetylcypholophine","C20H28N2O4","C10564","12747"
"3'-O-(4-Benzoyl)benzoyl ATP","C24H24N5O15P3","C13744","586333"
"Eucommin A","C27H34O12","C10560","12743"
"5-Hydroperoxy-6-trans-8,11,14-cis-eicosatetraenoate","C20H32O4","C05356","7733"
"Quetiapine","C21H25N3O2S","C07397","9601"
"Pamidronate","C3H11NO7P2","C07395","9599"
"Dihydrocubebin","C20H22O6","C10558","12741"
"UDP-2,3-bis(3-hydroxytetradecanoyl)glucosamine","C43H77N3O20P2","C04652","7239"
"1-alpha,24(R)-Dihydroxyvitamin D3","C27H44O3","C12919","583308"
"Iodixanol","C35H44I6N6O15","C12921","583310"
"Flurbiprofen axetil","C19H19FO4","C12922","583311"
"Nandrolone cyclohexanepropionate","C27H40O3","C12923","583312"
"Ebastine","C32H39NO2","C12925","583314"
"Periciazine","C21H23N3OS","C12932","583321"
"Rolitetracycline nitrate","C54H74N8O25","C12933","583322"
"Clocapramine dihydrochloride","C28H39Cl3N4O","C12937","583326"
"Oxymetebanol","C19H27NO4","C12944","583333"
"Butoctamide hydrogen succinate","C16H29NO5","C12946","583335"
"Promazine","C17H20N2S","C07379","9583"
"D-Arabinose 5-phosphate","C5H11O8P","C01112","4344"
"7,8-Dihydroxykynurenate","C10H7NO5","C01111","4343"
"Altanserin","C22H22FN3O2S","C11734","13899"
"O-Phospho-L-homoserine","C4H10NO6P","C01102","4336"
"L-Ribulose 5-phosphate","C5H11O8P","C01101","4335"
"Trimethylamine N-oxide","C3H9NO","C01104","4338"
"Orotidine 5'-phosphate","C10H13N2O11P","C01103","4337"
"1,2,3-Trihydroxybenzene","C6H6O3","C01108","4340"
"(R)-5-Phosphomevalonate","C6H13O7P","C01107","4339"
"5-Amino-2-oxopentanoic acid","C5H9NO3","C01110","4342"
"4-Methylene-L-glutamine","C6H10N2O3","C01109","4341"
"Feruloyl-CoA","C31H44N7O19P3S","C00406","3696"
"D-Aspartate","C4H7NO4","C00402","3692"
"(-)-Menthol","C10H20O","C00400","3690"
"Tryptamine","C10H12N2","C00398","3688"
"Tobramycin","C18H37N5O9","C00397","3687"
"Pyrimidine","C4H4N2","C00396","3686"
"GDPglucose","C16H25N5O16P2","C00394","3684"
"Mannitol","C6H14O6","C00392","3682"
"Isocaproic acid","C6H12O2","","269136"
"Isovalerylcarnitine","C12H23NO4","","746759"
"Isoursodeoxycholic acid","C24H40O4","","704241"
"Methyl N-butyrylglycine","C7H13NO3","",""
"Harderoporphyrin","C35H36N4O6","","3882568"
"N-Valerylglycine methyl ester","C8H15NO3","",""
"L-Pipecolate","C6H11NO2","C00408","3698"
"L-Isoleucine","C6H13NO2","C00407","3697"
"(-)-Citronellol","C10H20O","C11386","13560"
"4-Carboxy-2-hydroxymuconate semialdehyde","C7H6O6","C04484","7103"
"Flavonol 3-O-D-glucoside","C21H22O11","C01130","4361"
"Cobamide coenzyme","C72H101CoN18O17P+","C00194","3494"
"D-Glucuronate","C6H10O7","C00191","3491"
"L-Threonine","C4H9NO3","C00188","3488"
"Cholesterol","C27H46O","C00187","3487"
"UDP-D-xylose","C14H22N2O16P2","C00190","3490"
"Ethanolamine","C2H7NO","C00189","3489"
"Glycerone","C3H6O3","C00184","3484"
"L-Valine","C5H11NO2","C00183","3483"
"(S)-Lactate","C3H6O3","C00186","3486"
"Cellobiose","C12H22O11","C00185","3485"
"Ciprofloxacin","C17H18FN3O3","C05349","7727"
"Antirhine","C19H24N2O","C09033","11225"
"Angustine","C20H15N3O","C09032","11224"
"L-Dopachrome","C9H7NO4","C01693","4834"
"Ergosterol","C28H44O","C01694","4835"
"Akuammicine","C20H22N2O2","C09025","11217"
"Ajmalicine","C21H24N2O3","C09024","11216"
"Akuammine","C22H26N2O4","C09027","11219"
"Akuammidine","C21H24N2O3","C09026","11218"
"Ptaerochromenol","C15H14O5","C09029","11221"
"Alstonine","C21H20N2O3","C09028","11220"
"Pulverochromenol","C20H22O4","C09031","11223"
"Ptaeroglycol","C15H14O6","C09030","11222"
"Nonaprenyl-4-hydroxybenzoate","C52H78O3","C03885","6618"
"Ngamma-Monomethyl-L-arginine","C7H16N4O2","C03884","6617"
"4,6-Dideoxy-4-oxo-dTDP-D-glucose","C16H24N2O15P2","C11907","14069"
"N-Acetyl-beta-D-glucosamine","C8H15NO6","C03878","6611"
"L-Serine-phosphoethanolamine","C5H13N2O6P","C03872","6606"
"N1-(5-Phospho-D-ribosyl)-AMP","C15H24N5O14P2+","C03883","6616"
"N-[(E,E)-Piperoyl]piperidine","C17H19NO3","C03882","6615"
"Indole-3-acetyl-myo-inositol","C16H19NO7","C03868","6603"
"Ethyl (S)-3-hydroxyhexanoate","C8H16O3","C03865","6600"
"L-2-Amino-6-oxoheptanedioate","C7H11NO5","C03871","6605"
"Isoorientin 2''-O-rhamnoside","C27H30O16","C03870","6604"
"Aspartame","C14H18N2O5","C11045","13228"
"2,2',4,4',5-Pentachlorodiphenyl ether","C12H5Cl5O","C11044","13227"
"Methoxychlor","C16H15Cl3O2","C11043","13226"
"Hexachlorobenzene","C6Cl6","C11042","13225"
"2,6-Dichlorothiobenzamide","C7H5Cl2NS","C11041","13224"
"2,6-Dichlorobenzonitrile","C7H3Cl2N","C11040","13223"
"2'-Deoxy-5-hydroxymethylcytidine-5'-triphosphate","C10H18N3O14P3","C11039","13222"
"2'-Deoxy-5-hydroxymethylcytidine-5'-diphosphate","C10H17N3O11P2","C11038","13221"
"Chlorothalonil","C8Cl4N2","C11037","13220"
"Bromobenzene","C6H5Br","C11036","13219"
"Diisopropyl phosphate","C6H15O4P","C03113","6008"
"Dimethylbenzimidazole","C9H10N2","C03114","6009"
"D-Threose 4-phosphate","C4H9O7P","C03109","6005"
"Deacetylcephalosporin C","C14H19N3O7S","C03112","6007"
"Glycoprotein inositol","C34H56N4O24","C03121","6014"
"Haloaromatic compound","C6H5","C03122","6015"
"Psychosine sulfate","C24H47NO10S","C02744","5704"
"Reduced-(S)-usnate","C18H18O7","C02747","5706"
"Avenacoside B","C57H92O28","C08888","11081"
"Avenacoside A","C51H82O23","C08887","11080"
"Phenolic phosphate","C6H7O4P","C02734","5695"
"Phenylethanolamine","C8H11NO","C02735","5696"
"N6-Methyl-L-lysine","C7H16N2O2","C02728","5690"
"Uscharidin","C29H38O9","C08883","11076"
"Asparagoside A","C33H54O8","C08886","11079"
"N6-Acetyl-L-lysine","C8H16N2O3","C02727","5689"
"(3-Arylcarbonyl)-alanine","C10H11NO3","C03450","6271"
"(+)-exo-5-Hydroxycamphor","C10H16O2","C03448","6270"
"(Z)-5-Oxohex-2-enedioate","C6H6O5","C03453","6273"
"(R)-S-Lactoylglutathione","C13H21N3O8S","C03451","6272"
"2,3,6-Trihydroxypyridine","C5H5NO3","C03458","6278"
"11-cis-Retinyl palmitate","C36H60O2","C03455","6275"
"Bicuculline","C20H17NO6","C09364","11555"
"Boldine","C19H21NO4","C09365","11556"
"Cnicin","C20H26O7","C09362","11553"
"Conchosin A","C15H18O5","C09363","11554"
"Berberastine","C20H18NO5+","C09360","11551"
"Chromolaenide","C22H28O7","C09361","11552"
"Chlorochrymorin","C15H19ClO5","C09358","11549"
"Chlorohyssopifolin A","C19H24Cl2O7","C09359","11550"
"Chamissonin diacetate","C19H24O6","C09356","11547"
"Berbamine","C37H40N2O6","C09357","11548"
"2-Hydroxy-3-(4-hydroxyphenyl)propenoate","C9H8O4","C05350","7728"
"N,N-Dimethyltryptamine","C12H16N2","C08302","10500"
"(+)-Neomenthyl O-beta-D-glucoside","C16H30O6","C04165","6847"
"Acebutolol","C18H28N2O4","C06803","9022"
"N-Acetylornithine","C7H14N2O3","C00437","3726"
"Acarbose","C25H43NO18","C06802","9021"
"2-Hydroxyphytanoyl-CoA","C41H74N7O18P3S","C07343","9550"
"(-)-Santiaguine","C38H48N4O2","C10170","12356"
"cis-2,3-Dihydro-2,3-dihydroxybiphenyl","C12H12O2","C06589","8817"
"Biphenyl","C12H10","C06588","8816"
"2-Hydroxy-6-oxo-7-methylocta-2,4-dienoate","C9H12O4","C06582","8811"
"Acetohexamide","C15H20N2O4S","C06806","9025"
"cis-2,3-Dihydro-2,3-dihydroxy-4'-chlorobiphenyl","C12H11ClO2","C06585","8813"
"Candesartan cilexetil","C33H34N6O6","C07709","9911"
"(-)-Sedamine","C14H21NO","C10171","12357"
"Acetohydroxamic acid","C2H5NO2","C06808","9027"
"Inosine-5'-carboxylate","C11H12N4O7","C03280","6139"
"Ursocholic acid","C24H40O5","","264152"
"Miglitol","C8H17NO5","C07708","9910"
"2-Oxodecanoic acid","C10H18O3","C13945","854188"
"Sennoside","C42H38O20","C13940","854184"
"Cholinephosphorylneogalatriaosylceramide","C63H122N2O21P+","C13938","854182"
"Cholinephosphorylmannosylneogalabiaosylceramide","C63H122N2O21P+","C13937","854181"
"9-Chloro-10-hydroxyhexadecanoic acid","C16H31ClO3","C13949","854192"
"16-Fluorohexadecanoic acid","C16H31FO2","C13948","854191"
"2-Methoxyhexadecanoic acid","C17H34O3","C13947","854190"
"2-Methoxy-6Z-hexadecenoic acid","C17H32O3","C13946","854189"
"UDP-N-acetyl-D-galactosaminuronic acid","C17H25N3O18P2","C13952","854195"
"Levocarnitine","C7H15NO3","C13951","854194"
"Tet-glycine","C3H5N5O2","C13738","586327"
"Dizocilpine","C16H15N","C13737","586326"
"(6Z,9Z,12Z)-Octadecatrienoic acid","C18H30O2","C06426","8661"
"(9Z,12Z,15Z)-Octadecatrienoic acid","C18H30O2","C06427","8662"
"(5Z,8Z,11Z,14Z,17Z)-Icosapentaenoic acid","C20H30O2","C06428","8663"
"Acetyltropine","C10H17NO2","C12452","582842"
"beta-Cellobiose","C12H22O11","C06422","8657"
"Octanoic acid","C8H16O2","C06423","8658"
"Tetradecanoic acid","C14H28O2","C06424","8659"
"Icosanoic acid","C20H40O2","C06425","8660"
"5-Aminopentanal","C5H11NO","C12455","582845"
"D-Galacturonolactone","C6H8O6","C06430","8665"
"5'-Benzoylphosphoadenosine","C17H18N5O8P","C06433","8667"
"Anatalline","C15H17N3","C12454","582844"
"2-O-alpha-L-Rhamnopyranosyl-D-glucopyranose","C12H22O10","C08244","10443"
"Propanoyl phosphate","C3H7O5P","C02876","5809"
"Verapamil","C27H38N2O4","C07188","9397"
"Geranoyl-CoA","C31H50N7O17P3S","C01920","5026"
"alpha-D-Mannoheptulopyranose","C7H14O7","C08236","10435"
"beta-D-Digitalopyranose","C7H14O5","C08235","10434"
"alpha-Galactosyl-(1-6)-alpha-galactosyl-(1-6)-alpha-galactosyl-(1-6)-alpha-galactosyl-(1-6)-alpha-glucosyl-(1-2)-beta-fructose","C36H62O31","C08238","10437"
"9-O-Demethyl-2alpha-hydroxyhomolycorine","C17H19NO5","C12239","14384"
"Gentiobiose","C12H22O11","C08240","10439"
"beta-D-FructofuranosylO-beta-D-glucopyranosyl-(1-6)-alpha-D-glucopyranoside","C18H32O16","C08239","10438"
"Lychnose","C24H42O21","C08242","10441"
"Sodium2-O-L-rhamnopyranosyl-4-deoxy-alpha-L-threo-hex-4-eno-pyranosiduronate","C12H17NaO10","C08241","10440"
"1-Aminopropan-2-ol","C3H9NO","C05771","8066"
"Ribose triphosphate","C5H13O14P3","C02884","5815"
"Coproporphyrin III","C36H38N4O8","C05770","8065"
"Cleomiscosin A","C20H18O8","C09922","12108"
"Dethiobiotin","C10H18N2O3","C01909","5017"
"Coproporphyrin I","C36H38N4O8","C05769","8064"
"Quinapril hydrochloride","C25H31ClN2O5","C07340","9547"
"Disaccharide","C12H22O11","C01911","5019"
"2-Methylbutanoyl-CoA","C26H44N7O17P3S","C01033","4276"
"Coproporphyrinogen I","C36H44N4O8","C05768","8063"
"D-Hamamelose","C6H12O6","C01906","5015"
"Undecaprenyl phosphate","C55H91O4P","C00348","3641"
"alpha-Ribazole","C14H18N2O4","C05775","8070"
"Daunorubicin","C27H29NO10","C01907","5016"
"N8-Acetylspermidine","C9H21N3O","C01029","4273"
"Cobinamide","C48H72CoN11O8+2","C05774","8069"
"S-Formylglutathione","C11H17N3O7S","C01031","4274"
"Cobyrinate","C45H59CoN4O14+","C05773","8068"
"7,8-Diaminononanoate","C9H20N2O2","C01037","4280"
"Precorrin 3A","C43H50N4O16","C05772","8067"
"Secalciferol","C27H44O3","C07712","9914"
"L-Gulono-1,4-lactone","C6H10O6","C01040","4282"
"L-Glutamine","C5H10N2O3","C00064","3364"
"4-Guanidinobutanoate","C5H11N3O2","C01035","4278"
"4-Maleylacetoacetate","C8H8O6","C01036","4279"
"L-3-Amino-isobutanoate","C4H9NO2","C03284","6143"
"5-b-Cholestane-3a-7-tetraol","C27H48O4","","584957"
"Pseudooxynicotine","C10H14N2O","","585025"
"trans-3-Hydroxycotinine glucuronide","C16H20N2O8","","585018"
"Zaragozic acid C","C40H50O14","","853836"
"4a-Methyl zymosterol","C28H46O","","7531"
"N-(6-Aminohexyl)-1-chloro-naphthalene- 5-sulfonamide","C16H21ClN2O2S","","853819"
"Tricosanoic acid","C23H46O2","","260798"
"2,4-Decadienoyl-CoA","C31H50N7O17P3S","","773758"
"N,N-Dimethyladenine","C7H9N5","","326310"
"4a-Formyl-5a-cholesta-8,24-dien-3b-ol","C28H44O2","","853833"
"Taxa-4(20),11(12)-dien-5alpha-acetoxy-10beta-ol","C22H34O3","C11898","14060"
"10-Deacetyl-2-debenzoylbaccatin III","C22H32O9","C11899","14061"
"Baccatin III","C31H38O11","C11900","14062"
"Copalyl diphosphate","C20H36O7P2","C11901","14063"
"Taxa-4(5),11(12)-diene","C20H32","C11894","14056"
"Taxa-4(20),11(12)-dien-5alpha-ol","C20H32O","C11895","14057"
"Taxa-4(20),11(12)-dien-5alpha-yl acetate","C22H34O2","C11896","14058"
"Taxa-4(20),11(12)-dien-5alpha,13alpha-diol","C20H32O2","C11897","14059"
"syn-Copalyl diphosphate","C20H36O7P2","C11902","14064"
"Methanophenazine","C37H50N2O","C11903","14065"
"3,3'-Dihydroxyhexestrol","C18H22O4","C14243","7847053"
"4-(Benzyloxyl)phenol","C13H12O2","C14244","7847054"
"4-Dodecylphenol","C18H30O","C14245","7847055"
"2,4'-Dichlorobiphenyl","C12H8Cl2","C14246","7847056"
"3-Deoxyestradiol","C18H24O","C14239","7847049"
"Di(2-ethylhexyl) adipate","C22H42O4","C14240","7847050"
"4'-Hydroxyflavanone","C15H12O3","C14241","7847051"
"Mytatrienediol","C20H28O3","C14242","7847052"
"2,2',4,4'-Tetrachlorobiphenyl","C12H6Cl4","C14247","7847057"
"4,4'-Dichlorobiphenyl","C12H8Cl2","C14248","7847058"
"3a,6b,7b-Trihydroxy-5b-cholanoic acid","C24H40O5","","3885276"
"Permethrin","C21H20Cl2O3","C14388","181314"
"1,1,1-Trichloro-2-(4-hydroxyphenyl)-2-(4-methoxyphenyl)ethane","C15H13Cl3O2","C14389","3886517"
"3b,15b,17a-TrihydroxyPregnenone","C21H32O4","","709722"
"2-Methyl-3-hydroxybutyric acid","C5H10O3","","737967"
"3-Deoxyarabinohexonic acid","C6H12O6","","730493"
"16b-Hydroxyestradiol","C18H24O3","","382672"
"2-Methoxyestradiol-3-methylether","C20H28O3","",""
"3-Hydroxyadipic acid","C6H10O5","","729458"
"Benzo[b]fluorene","C17H12","C14384","152392"
"2-Ethylphenol","C8H10O","C14385","150013"
"3b,12a-Dihydroxy-5a-cholanoic acid","C24H40O4","",""
"3,4-Dihydroxydihydro-2(3H)-furanone","C4H6O4","",""
"7-Methylguanine","C6H7N5O","C02242","5305"
"7-Methyladenine","C6H7N5","C02241","5304"
"3-Oxopentanoic acid","C5H8O3","C02233","5297"
"3-Oxoadipyl-CoA","C27H42N7O20P3S","C02232","5296"
"4-Nitrocatechol","C6H5NO4","C02235","5299"
"4-Cyanopyridine","C6H4N2","C02234","5298"
"5-Oxo-D-proline","C5H7NO3","C02237","5301"
"4-Sulfobenzoate","C7H6O5S","C02236","5300"
"5-Valerolactone","C5H8O2","C02240","5303"
"5-Oxo-L-proline","C5H7NO3","C02238","5302"
"Hyoscyamine sulfate dihydrate","C34H52N2O12S","C07857","10059"
"2-Deoxystreptamine phospahte","C6H15N2O6P","C03828","6571"
"2-Hydroxyethylenedicarboxylate","C4H4O5","C03981","6698"
"Tridihexethyl","C21H36NO+","C07861","10063"
"Obamegine","C36H38N2O6","C06513","8744"
"2-Dehydro-2-deoxy-D-fuconate","C6H10O5","C03825","6568"
"1F-alpha-D-Galactosylraffinose","C24H42O21","C03971","6691"
"4-Hydroxystyrene","C8H8O","C05627","7942"
"3D,7D,11D-Phytanic acid","C29H40O2","",""
"2'-Norberbamunine","C35H38N2O6","C06512","8743"
"Sarpagine","C19H22N2O2","C09239","11430"
"Sempervirine","C19H16N2","C09240","11431"
"Serpentine","C21H20N2O3","C09241","11432"
"Tabernamine","C40H48N4O2","C09242","11433"
"(-)-Quebrachamine","C19H26N2","C09235","11426"
"Rhyncophylline","C22H28N2O4","C09236","11427"
"Roxburghine B","C31H32N4O2","C09237","11428"
"Rutecarpine","C18H13N3O","C09238","11429"
"6,8-Di-DMA-chrysin","C25H26O4","C11573","13738"
"Tetrahydroharmine","C13H16N2O","C09243","11434"
"Tabersonine","C21H24N2O2","C09244","11435"
"Deisopropylatrazine","C5H8ClN5","C06556","8785"
"Magnoline","C36H40N2O6","C06515","8746"
"dTDP-L-oleandrose","C17H28N2O14P2","C11921","14082"
"2-Amino-4,7-dihydroxypteridine","C6H5N5O2","C03975","6694"
"Tetrahydroxypteridine","C6H4N4O4","C03178","6060"
"Deisopropylhydroxyatrazine","C5H9N5O","C06557","8786"
"Aromoline","C36H38N2O6","C06514","8745"
"Benzo[ghi]perylene","C22H12","C14318","152308"
"8-Geranylchrysin","C25H26O4","C11575","13740"
"Adenosyl cobinamide phosphate","C58H85CoN16O14P","C06509","8740"
"(R)-4-Hydroxymandelate","C8H8O4","C05343","7721"
"Adenosyl cobinamide","C58H84CoN16O11+","C06508","8739"
"dTDP-L-mycarose","C17H28N2O14P2","C11916","14077"
"Malonylapiin","C29H30O17","C05622","7939"
"4-(Dimethylamino)phenylazoxybenzene","C14H15N3O","C04291","6951"
"5,7,4'-Trihydroxy-3'-methoxyflavone","C16H12O6","C04293","6953"
"1-Guanidino-1-deoxy-scyllo-inositol","C7H15N3O5","C04280","6942"
"L-1-Pyrroline-3-hydroxy-5-carboxylate","C5H7NO3","C04281","6943"
"1-Pyrroline-4-hydroxy-2-carboxylate","C5H7NO3","C04282","6944"
"2-Heptyl-4-hydroxyquinoline-N-oxide","C16H21NO2","C04284","6946"
"3,5-Dibromo-4-hydroxyphenylpyruvate","C9H6Br2O4","C04285","6947"
"3,5-Dinitro-4-hydroxyphenylpyruvate","C9H6N2O8","C04286","6948"
"3,5/4-Trihydroxycyclohexa-1,2-dione","C6H8O5","C04287","6949"
"4-(3-Methylbut-2-enyl)-L-tryptophan","C16H20N2O2","C04290","6950"
"Lunularin","C14H14O2","C10269","12455"
"Lunularic acid","C15H14O4","C10268","12454"
"Loroglossol","C16H16O3","C10267","12453"
"Guattegaumerine","C36H40N2O6","C06511","8742"
"Isobatatasin I","C17H16O4","C10265","12451"
"3-Hydroxy-5-methoxy-6-prenylstilbene-2-carboxylic acid","C21H22O4","C10264","12450"
"Amabiline","C15H25NO4","C10263","12449"
"Hydrangenol","C15H12O4","C10262","12448"
"3'-O-Methylbatatasin III","C16H18O3","C10271","12457"
"Marchantin A","C28H24O5","C10270","12456"
"Cochlearine","C15H19NO3","C10853","13036"
"Convolamine","C17H23NO4","C10854","13037"
"Rosmarinine","C18H27NO6","C10380","12566"
"Obtusifolin 2-glucoside","C22H22O10","C10381","12567"
"Phytoene","C40H64","C05413","7779"
"L-Lyxonate","C5H10O6","C05412","7778"
"Benzoylecgonine","C16H19NO4","C10847","13030"
"Tropacocaine","C15H19NO2","C10848","13031"
"Belladonnine","C34H42N2O4","C10845","13028"
"Norobtusifolin","C15H10O5","C10379","12565"
"9-Methoxy-alpha-lapachone","C16H16O4","C10372","12558"
"Cinnamoylcocaine","C19H23NO4","C10852","13035"
"Morindaparvin A","C15H8O4","C10374","12560"
"Riddelline","C18H23NO6","C10375","12561"
"Psilocybin","C12H17N2O4P","C07576","9779"
"Adenosine-GDP-cobinamide","C68H97CoN21O21P2","C06510","8741"
"(R,S)-Norreticuline","C18H21NO4","C12329","582719"
"Reticuline","C19H23NO4","C12328","582718"
"Pteridine","C6H4N4","C07581","9783"
"Pteroic acid","C14H12N6O3","C07582","9784"
"NAC-Diketide","C15H17NO4S","C12089","14238"
"4-Hydroxycinnamoylmethane","C10H10O2","C12088","14237"
"p-Coumaroyltriacetic acid lactone","C15H12O5","C12087","14236"
"dTDP-L-vancosamine","C17H29N3O13P2","C12322","582712"
"dTDP-L-epivancosamine","C17H29N3O13P2","C12321","582711"
"dTDP-L-4-oxovancosamine","C17H27N3O13P2","C12320","582710"
"Laudanosoline","C17H19NO4","C12327","582717"
"Resistomycin","C22H16O6","C12080","14231"
"3,5-Dihydroxyphenylglyoxylate","C8H6O5","C12325","582715"
"3,5-Dihydroxyphenylacetyl-CoA","C29H42N7O19P3S","C12324","582714"
"1,6,6-Trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one","C10H16O3","C04718","7290"
"1-Hydroxy-2-(beta-D-glucosyloxy)-9,10-anthraquinone","C20H18O9","C04719","7291"
"(25S)-5beta-Spirostan-3beta-ol 3-O-beta-D-glucoside","C33H54O8","C04716","7288"
"(9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoic acid","C18H32O4","C04717","7289"
"N6-(delta2-Isopentenyl)-adenosine 5'-monophosphate","C15H22N5O7P","C04713","7285"
"(20S,22S,25S)-22,25-Epoxyfurost-5-ene-3beta,26-diol","C27H42O4","C04715","7287"
"5-(3-Hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene","C14H12O3S2","C04711","7283"
"7-(5-Carboxyl-5-oxopentanyl)-aminocephalosporinate","C16H18N2O9S","C04712","7284"
"(5Z,13E)-11alpha-Hydroxy-9,15-dioxoprost-13-enoate","C20H30O5","C04707","7280"
"3'-Deoxydihydrostreptomycin 3'alpha,6-bisphosphate","C21H41N7O18P2","C04709","7282"
"9'-cis-Neoxanthin","C40H56O4","C13431","586173"
"Chlorphenesin carbamate","C10H12ClNO4","C07930","10132"
"Chlorzoxazone","C7H4ClNO2","C07931","10133"
"Dantrolene sodium anhydrous","C14H9N4NaO5","C07933","10135"
"Metaxalone","C12H15NO3","C07934","10136"
"Metocurine","C40H48N2O6+2","C07919","10121"
"Metyrosine","C10H13NO3","C07921","10123"
"Carisoprodol","C12H24N2O4","C07927","10129"
"Chlorphenesin","C9H11ClO3","C07928","10130"
"Orphenadrine","C18H23NO","C07935","10137"
"Riluzole","C8H5F3N2OS","C07937","10139"
"Edrophonium","C10H16NO+","C06976","9190"
"Enalapril","C20H28N2O5","C06977","9191"
"6-Benzylaminopurine","C12H11N5","C11263","13440"
"Pinguisone","C15H20O2","C09710","11899"
"Roridin A","C29H40O9","C09716","11904"
"Traumatic acid","C12H20O4","","73836"
"gamma-Oryzanol","C40H58O4","C12648","583038"
"Citric acid monohydrate","C6H10O8","C12649","583039"
"Capecitabine","C15H22FN3O6","C12650","583040"
"Phenylpropanolamine hydrochloride","C9H14ClNO","C12651","583041"
"Sulpiride","C15H23N3O4S","C12653","583043"
"Paramethasone acetate","C24H31FO6","C12656","583046"
"Flunitrazepam","C16H12FN3O3","C12657","583047"
"Pantethine","C22H42N4O8S2","C12661","583051"
"Leucomycin A3","C42H69NO15","C12662","583052"
"Amogastrin","C35H46N6O8S","C12664","583054"
"alpha-Tocopherol acetate","C31H52O3","C13202","585946"
"Nandrolone furylpropionate","C25H32O4","C13204","585948"
"(R)-3-Hydroxybutanoate","C4H8O3","C01089","4324"
"(R)-3,3-Dimethylmalate","C6H10O5","C01088","4323"
"(R)-2-Hydroxyglutarate","C5H8O5","C01087","4322"
"alpha,alpha-Trehalose","C12H22O11","C01083","4320"
"Thiamin monophosphate","C12H18N4O4PS+","C01081","4319"
"Reduced coenzyme F420","C29H38N5O18P","C01080","4318"
"Protoporphyrinogen IX","C34H40N4O4","C01079","4317"
"O-Acetyl-L-homoserine","C6H11NO4","C01077","4315"
"N-Sulfo-D-glucosamine","C6H13NO8S","C01075","4313"
"N-Acetyl-beta-alanine","C5H9NO3","C01073","4311"
"L-Threoneopterin","C9H11N5O4","","680263"
"Isovalerylglutamic acid","C10H17NO5","","709658"
"Hyodeoxycholic acid","C24H40O4","","265769"
"Isobutyrylglycine","C6H11NO3","",""
"Glycyl-L-proline","C7H12N2O3","","249336"
"Isolithocholic acid","C24H40O3","","742326"
"L-a-Lysophosphatidylcholine","C22H46NO7P","",""
"Methylcitric acid","C7H10O7","",""
"Heptaporphyrin I","C39H38N4O14","",""
"Isobutyryl-L-carnitine","C11H21NO4","","745859"
"Hydantoin-5-propionate","C6H8N2O4","C05565","7893"
"N-Propanoylimidazole","C6H8N2O","C03007","5915"
"Imidazole lactate","C6H8N2O3","C05568","7894"
"(-)-Maackiain","C16H12O5","C10502","12685"
"4-Oxoglutaramate","C5H7NO4","C05572","7898"
"Isoglutamate","C5H9NO4","C05574","7900"
"Haloperidol decanoate","C31H41ClFNO3","C13370","586114"
"Dihydroxycarbazepine","C15H14N2O3","C07495","9698"
"Soman","C7H16FO2P","C07494","9697"
"10-Hydroxycarbazepine","C15H14N2O2","C07493","9696"
"5-O-beta-D-Mycaminosyltylactone","C31H53NO8","C12001","14162"
"Oxcarbazepine","C15H12N2O2","C07492","9695"
"Tylactone","C23H38O5","C12000","14161"
"Phenylethylmalonamide","C11H14N2O2","C07499","9702"
"Demethyllactenocin","C37H61NO14","C12003","14164"
"Malaoxon","C10H19O7PS","C07498","9701"
"Coleonol","C22H34O7","C09076","11268"
"5-O-beta-D-Mycaminosyltylonolide","C31H51NO10","C12002","14163"
"Malathion","C10H19O6PS2","C07497","9700"
"Bacitracin","C66H103N17O16S","C01667","4814"
"Narbonolide","C20H32O5","C11997","14158"
"Carbamazepine-10,11-epoxide","C15H12N2O2","C07496","9699"
"Arene diol","C6H8O2","C01666","4813"
"Domperidone","C22H24ClN5O2","C13212","585956"
"Methymycin","C25H43NO7","C11996","14157"
"Vicianose","C11H20O10","C01625","4776"
"Vindoline","C25H32N2O6","C01626","4777"
"Xylobiose","C10H18O9","C01630","4780"
"Aldohexose","C6H12O6","C01662","4810"
"Z-Gly-Pro","C15H18N2O5","C01632","4782"
"1-Decanol","C10H22O","C01633","4783"
"Fusicoccin H","C26H42O8","C09093","11285"
"Ferruginol","C20H30O","C09092","11284"
"Euphorbia factor Ti2","C32H42O7","C09091","11283"
"Daphnetoxin","C27H30O8","C09080","11272"
"Calligonine","C12H14N2","C09089","11281"
"Callichiline","C42H48N4O5","C09088","11280"
"Diterpenoid SP-II","C20H32O4","C09087","11279"
"Diterpenoid EF-D","C27H38O7","C09086","11278"
"Calebassone","C40H48N4O2+2","C09085","11277"
"Chitobiose","C16H28N2O11","C01674","4818"
"Tamaulipin A","C15H20O3","C09556","11747"
"Tenulin","C17H22O5","C09557","11748"
"Laudanosine","C21H27NO4","C09558","11749"
"3,5,3'-Triiodothyropyruvate","C15H9I3O5","C03832","6574"
"Tetraneurin E","C17H24O6","C09560","11751"
"Thapsigargin","C34H50O12","C09561","11752"
"Tomentosin","C15H20O3","C09562","11753"
"Trilobolide","C27H38O10","C09563","11754"
"Arnebinol","C16H20O2","C09917","12103"
"Aucuparin","C14H14O3","C09918","12104"
"Boschniakine","C10H11NO","C09915","12101"
"6-Acetamido-3-aminohexanoate","C8H16N2O3","C03846","6583"
"Verbenone","C10H14O","C09913","12099"
"Bakankoside","C16H23NO8","C09914","12100"
"Umbellulone","C10H14O","C09911","12097"
"Arenaine","C11H17N3O","C09912","12098"
"Borreverine","C32H40N4","C09082","11274"
"4-Hydroxybutyryl-CoA","C25H42N7O18P3S","C11062","13244"
"all-trans-Retinoyl-beta-glucuronide","C26H36O8","C11061","13243"
"Fluorodifen","C13H7F3N2O5","C11064","13246"
"Chlornitrofen","C12H6Cl3NO3","C11063","13245"
"1,2,3,4-Tetrachlorodibenzodioxin","C12H4Cl4O2","C11058","13240"
"3,4,3',4'-Tetrachlorobiphenyl","C12H6Cl4","C11057","13239"
"(-)-Abscisic acid","C15H20O4","C11060","13242"
"1,3,6,8-Tetrachlorodibenzo-p-dioxin","C12H4Cl4O2","C11059","13241"
"MC-4379","C14H9Cl2NO5","C11066","13248"
"Nitrofen","C12H7Cl2NO3","C11065","13247"
"2-Deoxystreptidine","C8H18N6O3","C02628","5609"
"Parillin","C51H84O22","C08906","11098"
"2-Isopropylmaleate","C7H10O4","C02631","5611"
"Officinalisnin I","C45H76O19","C08904","11096"
"Sarsaparilloside","C57H96O28","C08911","11103"
"Ruscoside","C50H80O23","C08910","11102"
"Ruscogenin","C27H42O4","C08909","11101"
"Protogracillin","C51H84O23","C08908","11100"
"Smilagenin","C27H44O3","C08913","11105"
"Sarsasapogenin 3-O-4G-rhamnosylsophoroside","C45H74O17","C08912","11104"
"20-Hydroxyecdysone","C27H44O7","C02633","5613"
"3-Chloro-D-alanine","C3H6ClNO2","C02634","5614"
"Cassyfiline","C19H19NO5","C09380","11571"
"Isocorydine","C20H23NO4","C09549","11740"
"Costunolide","C15H20O2","C09382","11573"
"alpha-Cyclocostunolide","C15H20O2","C09383","11574"
"Confertifolin","C15H22O2","C09376","11567"
"Caseadine","C20H23NO4","C09377","11568"
"Confertin","C15H20O3","C09378","11569"
"Coriamyrtin","C15H18O5","C09379","11570"
"beta-Cyclocostunolide","C15H20O2","C09384","11575"
"Cynaropicrin","C19H22O6","C09385","11576"
"2-Methylbut-2-enoyl-CoA","C26H42N7O17P3S","C03345","6188"
"2-Methylacetoacetyl-CoA","C26H42N7O18P3S","C03344","6187"
"Cyperine","C15H16O4","C09923","12109"
"Dihydromethysticin","C15H16O5","C09926","12112"
"2-Aminomuconate semialdehyde","C6H7NO3","C03824","6567"
"alpha-D-Mannose 1-phosphate","C6H13O9P","C03812","6559"
"Euglobal-Ia1","C23H30O5","C09927","12113"
"Miraxanthin-I","C14H18N2O7S","C08554","10747"
"Protodioscin","C51H84O22","C08907","11099"
"5alpha-Cholesta-7,24-dien-3beta-ol","C27H44O","C05439","7801"
"Miraxanthin-II","C13H14N2O8","C08555","10748"
"Miraxanthin-III","C17H18N2O5","C08556","10749"
"Tagitinin F","C19H24O6","C09554","11745"
"Tuberonic acid glucoside","C18H28O9","C08558","10751"
"Musca-aurin-I","C14H13N3O8","C08559","10752"
"Pisatin","C17H14O6","C10516","12699"
"(-)-Phaseollinisoflavan","C20H20O4","C10515","12698"
"Piscerythramine","C26H29NO6","C10518","12701"
"2-(beta-D-Glucosyl)-sn-glycerol 3-phosphate","C9H19O11P","C10517","12700"
"Pratensein","C16H12O6","C10520","12703"
"Pomiferin","C25H24O6","C10519","12702"
"Pseudobaptigenin","C16H10O5","C10522","12705"
"Prunetin","C16H12O5","C10521","12704"
"Puerarin","C21H20O9","C10524","12707"
"Psoralidin","C20H16O5","C10523","12706"
"Tuliposide A","C11H18O8","C08561","10754"
"18-Hydroxycortisol","C21H30O6","","700374"
"S-Methyl GSH","C11H19N3O6S","C11347","13522"
"16alpha,17beta-Estriol 17-(beta-D-glucuronide)","C24H31O9-","C11346","13521"
"Precorrin 3B","C43H50N4O17","C06406","8641"
"Precorrin 4","C44H52N4O17","C06407","8642"
"Antimycin A1","C28H40N2O9","C11339","13514"
"Bornyl acetate","C12H20O2","C11338","13513"
"N-Acetylphenylalanine beta-naphthyl ester","C21H19NO3","C11341","13516"
"Antimony potassium tartrate","C8H22K2O15Sb2","C11340","13515"
"Salicylhydroxamic acid","C7H7NO3","C11343","13518"
"Oxolinic acid","C13H11NO5","C11342","13517"
"Triazolealanine","C5H8N4O2","C11345","13520"
"Methyl tert-butyl ether","C5H12O","C11344","13519"
"Montanol","C21H36O4","C09137","11329"
"6-Methylpretetramide","C20H15NO6","C06629","8855"
"Descarbamoylnovobiocin","C30H35NO10","C12476","582866"
"3-Methylpyrrole-2,4-dicarboxylic acid","C7H7NO4","C12477","582867"
"Alliin","C6H11NO3S","C08265","10464"
"L-Albizziine","C4H9N3O3","C08264","10463"
"Novclobiocin 105","C28H30ClNO10","C12472","582862"
"Novclobiocin 104","C29H32ClNO10","C12473","582863"
"Novobiocic acid","C22H21NO6","C12474","582864"
"Volemitol","C7H16O7","C08260","10459"
"3-Amino-4,7-dihydroxy-8-methylcoumarin","C10H9NO4","C12466","582856"
"(+)-Quercitol","C6H12O5","C08258","10457"
"(-)-Quebrachitol","C7H14O6","C08257","10456"
"Pinitol","C7H14O6","C08256","10455"
"dTDP-alpha-D-desosamine","C18H31N3O13P2","C06632","8858"
"Melicopicine","C18H19NO5","C10722","12905"
"4-Dedimethylamine-4-oxo-anhydro-7-Cl-tetracycline","C20H14ClNO8","C06626","8852"
"4-Dedimethylamino-4-oxo-anhydrotetracycline","C20H15NO8","C06627","8853"
"3-O-Methylgallate","C8H8O5","C05616","7935"
"beta-Butoxyethyl nicotinate","C12H17NO3","C13138","585202"
"4-Hydroxy-6-methylpretetramide","C20H15NO7","C06628","8854"
"Nitrendipine","C18H20N2O6","C07713","9915"
"alpha-Naphthyl-beta-D-glucuronide","C16H16O7","C11586","13751"
"BQ 123","C31H42N6O7","C11587","13752"
"cis-3-(Carboxy-ethyl)-3,5-cyclo-hexadiene-1,2-diol","C9H12O4","C11588","13753"
"BQ 518","C32H38N6O7S","C11589","13754"
"2-Chlorophenylhydrazine hydrochloride","C6H8Cl2N2","C11582","13747"
"4-Glutathionyl cyclophosphamide","C17H30Cl2N5O8PS","C11583","13748"
"4-Methylumbelliferone glucuronide","C16H16O9","C11584","13749"
"4-Methylumbelliferone sulfate","C10H8O6S","C11585","13750"
"dTDP-beta-D-olivose","C16H26N2O14P2","C12445","582835"
"Beauvericin","C45H57N3O9","C11590","13755"
"DIDS","C16H10N2O6S4","C11591","13756"
"Undecylenic acid","C11H20O2","C13910","854155"
"Diphosphoryl heptaacyl lipid A","C110H208N2O26P2","C13909","854154"
"1-Palmitoyl-2-(5-keto-6-octendioyl)-sn-glycero-3-phosphatidylcholine","C32H58NO11P","C13900","854145"
"Prednisolone succinate","C25H32O8","C13899","854144"
"1-Palmitoyl-2-(5-keto-8-oxo-6-octenoyl)-sn-glycero-3-phosphatidylcholine","C32H58NO10P","C13902","854147"
"1-Palmitoyl-2-(5-hydroxy-8-oxo-6-octenoyl)-sn-glycero-3-phosphatidylcholine","C32H60NO10P","C13901","854146"
"Balofloxacin","C20H24FN3O4","C13906","854151"
"1-O-Hexadecyl-lyso-sn-glycero-3-phosphocholine","C24H52NO6P","C13903","854148"
"Diphosphoryl hexaacyl lipid A","C94H178N2O25P2","C13908","854153"
"OM-174","C52H100N2O20P2","C13907","854152"
"Gemcitabine","C9H11F2N3O4","C07650","9852"
"5-FU","C4H3FN2O2","C07649","9851"
"Thioguanine","C5H5N5S","C07648","9850"
"SB 200646","C15H14N4O","C11739","13904"
"SB 206553","C17H16N4O","C11740","13905"
"Abietinol","C20H32O","C11882","14044"
"Levopimarinol","C20H32O","C11883","14045"
"m-Chlorobenzamide","C7H6ClNO","C11731","13896"
"(+)-Sandaracopimaradiene","C20H32","C11877","14039"
"Decamethonium","C16H38N2+2","C11733","13898"
"Procyclidine","C19H29NO","C07378","9582"
"N-Ethylglycine","C4H9NO2","C11735","13900"
"Palustradiene","C20H32","C11881","14043"
"CB3717","C24H23N5O6","C11737","13902"
"m-Chlorophenylpiperazine","C10H13ClN2","C11738","13903"
"4-Ketocyclophosphamide","C7H13Cl2N2O3P","C07644","9846"
"Mepyramine","C17H23N3O","C11798","13962"
"3-Methoxytropolone","C8H8O3","C02639","5619"
"Mitobronitol","C6H12Br2O4","C13522","853891"
"Hexestrol diacetate","C22H26O4","C13520","853890"
"Angiotensin II (human type)","C50H71N13O12","C13516","853888"
"Ferric gluconate","C18H33FeO21","C13511","853885"
"Tadalafil","C22H19N3O4","C13509","586229"
"Cefsulodin sodium","C22H19N4NaO8S2","C13505","586227"
"Sulfamonomethoxine sodium","C11H11N4NaO3S","C13501","853879"
"Prednisolone farnesylate","C36H50O6","C13498","586224"
"Budralazine","C14H16N4","C13497","853877"
"Polidocanol","C30H62O10","C13493","853875"
"Cytidine","C9H13N3O5","C00475","3758"
"Ribitol","C5H12O5","C00474","3757"
"Coniferyl alcohol","C10H12O3","C00590","3869"
"Retinol","C20H30O","C00473","3756"
"Quinone","C6H4O2","C00472","3755"
"Mifepristone","C29H35NO2","C07652","9854"
"Propanal","C3H6O","C00479","3762"
"WR 1065","C5H14N2S","C07651","9853"
"Lichenin","C6H10O5","C00478","3761"
"3-Hydroxyanthranilate","C7H7NO3","C00632","3905"
"Deoxyanisatin","C15H20O7","C12076","14227"
"2-Phospho-D-glycerate","C3H7O7P","C00631","3904"
"6,7-Dimethyl-8-(1-D-ribityl)lumazine","C13H18N4O6","C04332","6983"
"Palustric acid","C20H30O2","C12077","14228"
"Decachlorobiphenyl","C12Cl10","C14368","159577"
"2,2',3,3',6,6'-Hexachlorobiphenyl","C12H4Cl6","C14369","179283"
"2,3,4,5,6-Pentachlorobiphenyl","C12H5Cl5","C14366","171382"
"2,2',3,3',5,5'-Hexachlorobiphenyl","C12H4Cl6","C14367","178639"
"2,4,4',6-Tetrachlorobiphenyl","C12H6Cl4","C14364","205296"
"2,3,3',4,5-Pentachlorobiphenyl","C12H5Cl5","C14365","189343"
"2,3,4,5-Tetrachlorobiphenyl","C12H6Cl4","C14362","177911"
"2,3,5,6-Tetrachlorobiphenyl","C12H6Cl4","C14363","177912"
"2,2',4,5-Tetrachlorobiphenyl","C12H6Cl4","C14360","189323"
"2,3,4,4'-Tetrachlorobiphenyl","C12H6Cl4","C14361","177820"
"3-Ethoxybenzoate","C9H10O3","C02363","5408"
"2-Oxosuccinamate","C4H5NO4","C02362","5407"
"2-Hydroxyadipate","C6H10O5","C02360","5406"
"2-Fluorobenzoate","C7H5FO2","C02359","5405"
"2-Chlorobenzoate","C7H5ClO2","C02357","5404"
"(S)-2-Aminobutanoate","C4H9NO2","C02356","5403"
"2',3'-Cyclic UMP","C9H11N2O8P","C02355","5402"
"2',3'-Cyclic CMP","C9H12N3O7P","C02354","5401"
"2',3'-Cyclic AMP","C10H12N5O6P","C02353","5400"
"1,2-Benzoquinone","C6H4O2","C02351","5398"
"Osalmid","C13H11NO3","C13036","583425"
"Pranoprofen","C15H13NO3","C13035","583424"
"Kebuzone","C19H18N2O3","C13023","583412"
"Indomethacin farnesil","C34H40ClNO4","C13021","583410"
"Aranidipine","C19H20N2O7","C13018","583407"
"Carumonam sodium","C12H12N6Na2O10S2","C13016","583405"
"Bronopol","C3H6BrNO4","C13034","583423"
"Estramustine phosphate sodium","C23H30Cl2NNa2O6P","C13031","583420"
"Etilefrine hydrochloride","C10H16ClNO2","C13029","583418"
"Cefpimizole sodium","C28H25N6NaO10S2","C13024","583413"
"Dammarenediol-I","C30H52O2","C08621","10814"
"4-Carboxy-2-hydroxy-cis,cis-muconate","C7H6O7","C04324","6979"
"2,5-Dichlorohydroquinone","C6H4Cl2O2","C06600","8826"
"Hygrine","C8H15NO","C06179","8430"
"3,5-Dichloro-4-hydroxyphenylpyruvate","C9H6Cl2O4","C04323","6978"
"PQQ","C14H6N2O8","C00113","3413"
"Choline","C5H14NO+","C00114","3414"
"Imazalil nitrate","C14H14Cl2N3O4-","C11219","13399"
"D-Glucose 1-phosphate","C6H13O9P","C00103","3403"
"IDP","C10H14N4O11P2","C00104","3404"
"UMP","C9H13N2O9P","C00105","3405"
"Uracil","C4H4N2O2","C00106","3406"
"Anthranilate","C7H7NO2","C00108","3408"
"2-Oxobutanoate","C4H6O3","C00109","3409"
"Glycerone phosphate","C3H7O6P","C00111","3411"
"CDP","C9H15N3O11P2","C00112","3412"
"3alpha,7alpha,12alpha-Trihydroxy-5beta-cholest-24-enoyl-CoA","C48H78N7O20P3S","C05460","7820"
"Muscapurpurin","C18H14N2O10","C08563","10756"
"Esculetin","C9H6O4","C09263","11454"
"Esculin","C15H16O9","C09264","11455"
"Decuroside III","C26H34O14","C09257","11448"
"Decursin","C19H20O5","C09258","11449"
"Vomicine","C22H24N2O4","C09255","11446"
"Yohimbine","C21H26N2O3","C09256","11447"
"Disenecionyl cis-khellactone","C24H26O7","C09261","11452"
"(3'R,4'R)-3'-Epoxyangeloyloxy-4'-acetoxy-3',4'-dihydroseselin","C21H22O8","C09262","11453"
"Decursinol","C14H14O4","C09259","11450"
"Dihydrosamidin","C21H24O7","C09260","11451"
"Cefaclor","C15H14ClN3O4S","C06877","9094"
"Gramicidin S","C60H92N12O10","C11218","13398"
"7alpha,12alpha-Dihydroxy-5alpha-cholestan-3-one","C27H46O3","C05458","7819"
"N2-Acetyl-L-glutamine","C7H12N2O4","","680315"
"5-Aminoimidazole","C3H5N3","C05239","7633"
"(R)-N-Methylcoclaurine","C18H21NO3","C05243","7636"
"10-Hydroxydihydrosanguinarine","C20H15NO5","C05247","7637"
"2-Amino-4-oxo-4-alpha-hydroxy-6-(erythro-1',2',3'-Tri-hydroxypropyl)-5,6,7,8-tetrahydroxypterin","C9H15N5O8","C05252","7640"
"2-Amino-4-oxo-6-(1',2',3'-trihydroxypropyl)-diquinoid-7,8-dihydroxypterin","C9H15N5O6","C05253","7641"
"2-Amino-4-oxo-6-(erythro-1',2',3'-trihydroxypropyl)-7,8-dihydroxypteridine triphosphate","C9H16N5O15P3","C05254","7642"
"2-Amino-4-oxo-6-(1',2'-dioxoprolyl)-7,8-dihydroxypteridine","C9H9N5O5","C05255","7643"
"L-2-Amino-hexano-6-lactam","C6H12N2O","C05256","7644"
"4-Methyl-5-(2-phosphoethyl)-thiazole","C6H10NO4PS","C04327","6980"
"3-Oxopalmitoyl-CoA","C37H64N7O18P3S","C05259","7646"
"cis,trans-4-Hydroxymuconic semialdehyde","C6H6O4","C06603","8829"
"(1-Hydroxycyclohexan-1-yl)acetyl-CoA","C29H48N7O18P3S","C04316","6974"
"Formylmethionyl-leucyl-phenylalanine methyl ester","C22H33N3O5S","C11221","13400"
"Parathion","C10H14NO5PS","C06604","8830"
"cis-1,2-Dihydronaphthalene-1,2-diol","C10H10O2","C04314","6972"
"Dimethylacryloyl-CoA","C26H42N7O17P3S","C02973","5885"
"3-Hydroxysebacic acid","C10H18O5","",""
"Glycodeoxycholate","C26H43NO5","C05464","7824"
"Hexadecanedioic acid mono-L-carnitine ester","C23H43NO6","",""
"3,4-Dihydro-2H-Pyrrole-2-carboxylate","C5H7NO2","C04322","6977"
"Fructose 1-phosphate","C6H13O9P","C02976","5887"
"Coelogin","C17H16O5","C10251","12437"
"Chlorophorin","C24H28O4","C10250","12436"
"Taurodeoxycholate","C26H45NO6S","C05463","7823"
"Batatasin IV","C15H16O3","C10247","12433"
"Batatasin I","C17H16O4","C10246","12432"
"Canaliculatol","C42H32O9","C10249","12435"
"Blestriarene B","C30H24O6","C10248","12434"
"1,2,3,4-Tetragalloyl-alpha-D-glucose","C34H28O22","C10243","12429"
"Terminalin","C28H10O16","C10242","12428"
"Astringin","C20H22O9","C10245","12431"
"Agrostophyllin","C17H14O4","C10244","12430"
"11-O-Demethyl-17-O-deacetylvindoline","C22H28N2O5","C04318","6976"
"1-O-Sinapoyl-beta-D-glucose","C17H22O10","C01175","4402"
"Zymosterol","C27H44O","C05437","7800"
"gamma-Carotene","C40H56","C05435","7799"
"Ergosta-5,7,22,24(28)-tetraen-3beta-ol","C28H42O","C05440","7802"
"Senecivernine","C18H25NO5","C10393","12579"
"Lycopene","C40H56","C05432","7796"
"Rapanone","C19H30O4","C10399","12585"
"beta-Zeacarotene","C40H58","C05434","7798"
"alpha-Carotene","C40H56","C05433","7797"
"Supinidine","C8H13NO","C10400","12586"
"Rhein","C15H8O6","C10401","12587"
"Phytosterol","C29H48O","C05442","7804"
"Vitamin D2","C28H44O","C05441","7803"
"Hypericin","C30H16O8","C07606","9808"
"AminoDAHP","C7H14NO10P","C12106","14253"
"AminoDHQ","C7H11NO5","C12109","14256"
"AminoDHS","C7H9NO4","C12108","14255"
"Ginkgolide B","C20H24O10","C07602","9804"
"Ginkgolide C","C20H24O11","C07603","9805"
"Allicin","C6H10OS2","C07600","9802"
"Ginkgolide A","C20H24O9","C07601","9803"
"Decanal","C10H20O","C12307","582698"
"Flavonol 3-O-beta-D-glucoside","C21H22O11","C03946","6669"
"Manumycin A","C31H38N2O7","C12111","14258"
"Gabaculine","C7H9NO2","C12110","14257"
"Hyperforin","C35H52O4","C07608","9810"
"Parthenolide","C15H20O3","C07609","9811"
"2,6-Diamino-4-hydroxy-5-(N-methyl)formamidopyrimidine","C6H9N5O2","C04744","7315"
"3beta-Hydroxy-5alpha-cholest-7-ene-4alpha-carboxylate","C28H46O3","C04746","7316"
"1-(5-Phospho-D-ribosyl)-5-amino-4-imidazolecarboxylate","C9H14N3O9P","C04751","7321"
"2-Methyl-4-amino-5-hydroxymethylpyrimidine diphosphate","C6H11N3O7P2","C04752","7322"
"UDP-N-acetyl-6-(D-galactose-1-phospho)-D-glucosamine","C23H38N3O25P3","C04739","7310"
"Alprostadil","C20H34O5","C04741","7312"
"(15S)-15-Hydroxy-5,8,11-cis-13-trans-eicosatetraenoate","C20H32O3","C04742","7313"
"(5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprosta-13-enoate","C20H32O5","C04743","7314"
"Glycoprotein N-acetyl-D-glucosaminyl-phospho-D-mannose","C42H71N6O31P","C04755","7324"
"(5Z,13E)-9alpha-Hydroxy-11,15-dioxoprosta-5,13-dienoate","C20H30O5","C04758","7326"
"N-Methylflindersine","C15H15NO2","C10731","12914"
"Undecaprenyl-diphospho-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine","C86H143N7O21P2","C05888","8176"
"beta-D-Glucopyranuronic acid","C6H10O7","C08350","10547"
"Dihydromethylsterigmatocystin","C18H14O7","C03944","6668"
"Reduced Vitamin K","C31H50O3","C05850","8143"
"Vitamin K epoxide","C31H46O3","C05849","8142"
"2-Hydroxyphenylacetate","C8H8O3","C05852","8145"
"Coumarine","C9H6O2","C05851","8144"
"4-Carboxy-2-oxo-4-pentanoate","C6H6O5","C05854","8147"
"Maleimide","C4H3NO2","C07272","9481"
"Thiamine aldehyde","C12H15N4OS+","C05856","8149"
"4-Hydroxycinnamyl alcohol 4-D-glucoside","C15H20O7","C05855","8148"
"Epothilone B","C27H41NO6S","C12154","14301"
"3,4,6-Trichlorocatechol","C6H3Cl3O2","C12831","583220"
"Tetraneurin A","C17H22O6","C09559","11750"
"Nicardipine","C26H29N3O6","C07264","9473"
"Nevirapine","C15H14N4O","C07263","9472"
"Poststerone","C21H30O5","C08837","11030"
"Tolciclate","C20H21NOS","C12822","583211"
"Simethicone","C8H24O2Si3","C07261","9470"
"Sildenafil","C22H30N6O4S","C07259","9468"
"Nizatidine","C12H21N5O2S2","C07270","9479"
"Xylopinine","C21H25NO4","C09671","11861"
"Niddamycin","C39H63NO14","C12152","14299"
"Nimodipine","C21H26N2O7","C07267","9476"
"Stigmatellin Y","C29H40O6","C12150","14297"
"Siccanin","C22H30O3","C12686","583076"
"Iotalamic acid","C11H9I3N2O4","C12687","583077"
"Benfotiamine","C19H23N4O6PS","C12684","583074"
"Cyclothiazide","C14H16ClN3O4S2","C12685","583075"
"Clobazam","C16H13ClN2O2","C12682","583072"
"Tofisopam","C22H26N2O4","C12683","583073"
"Ampicillin trihydrate","C16H25N3O7S","C12680","583070"
"Alclofenac","C11H11ClO3","C12681","583071"
"Flopropione","C9H10O4","C12688","583078"
"Fluorescein","C20H12O5","C12690","583080"
"3beta-Hydroxyandrost-5-en-17-one","C19H28O2","C01227","4449"
"Naphazoline hydrochloride","C14H15ClN2","C07898","10100"
"Pemoline","C9H8N2O2","C07899","10101"
"L-(-)-1-Butyl-2',6'-pipecoloxylidide","C18H28N2O","C07887","10089"
"Cyclophosphamide anhydrous","C7H15Cl2N2O2P","C07888","10090"
"Dextroamphetamine","C9H13N","C07884","10086"
"Brimonidine","C11H10BrN5","C07886","10088"
"Pramoxine","C17H27NO3","C07892","10094"
"Propoxycaine","C16H26N2O3","C07895","10097"
"Mephentermine","C11H17N","C07889","10091"
"Midodrine","C12H18N2O4","C07890","10092"
"alpha-D-Quinovopyranose","C6H12O5","C08352","10549"
"UDP-N-acetylmuramate","C20H31N3O19P2","C01050","4292"
"N5-Ethyl-L-glutamine","C7H14N2O3","C01047","4289"
"(R)-4-Dehydropantoate","C6H10O4","C01053","4294"
"Uroporphyrinogen III","C40H44N4O16","C01051","4293"
"N-Formyl-L-aspartate","C5H7NO5","C01044","4286"
"N-Carbamoylsarcosine","C4H8N2O3","C01043","4285"
"N-Methyl-L-glutamate","C6H11NO4","C01046","4288"
"N-Formyl-L-glutamate","C6H9NO5","C01045","4287"
"6-Phospho-D-gluconate","C6H13O10P","C00345","3638"
"Geranyl diphosphate","C10H20O7P2","C00341","3634"
"(S)-6-Hydroxynicotine","C10H14N2O","C01056","4296"
"(S)-2,3-Epoxysqualene","C30H50O","C01054","4295"
"Aminopterin","C19H20N8O5","","148719"
"Ethenodeoxyadenosine","C12H13N5O3","","682606"
"2-Hydroxycaproic acid","C6H12O3","","677184"
"5b-Cholestanol","C27H48O","","668217"
"trans-2-Octenoic acid","C8H14O2","","657307"
"m-Chlorobenzoic acid","C7H5ClO2","","36994"
"Threohydrobupropion","C13H20ClNO","","585032"
"Hexanoylcarnitine","C13H25NO4","",""
"Sultamicillin tosilate","C32H38N4O12S3","C13129","585193"
"Pseudopurpurin","C15H8O7","C10394","12580"
"Purpurin","C14H8O5","C10395","12581"
"Colchicine","C22H25NO6","C07592","9794"
"Pseudohypericin","C30H16O9","C10392","12578"
"Sarmentosin","C11H17NO7","C08340","10538"
"Proteacin","C20H27NO12","C08339","10537"
"Cascarillin","C22H32O7","C09071","11263"
"Ornithine","C5H12N2O2","C01602","4756"
"Baliospermin","C32H50O8","C09065","11257"
"Volkenin","C12H17NO7","C08344","10541"
"Triglochinin","C14H17NO10","C08342","10540"
"Tolylacetonitrile","C9H9N","C02596","5587"
"Ramentaceone","C11H8O3","C10398","12584"
"2-Deoxy-alpha-D-ribopyranose","C5H10O4","C08347","10544"
"beta-D-Apiose","C5H10O5","C08346","10543"
"(S)-Mandelonitrile","C8H7NO","C02615","5600"
"1,4-Naphthoquinone","C10H6O2","C02617","5602"
"Phytanate","C20H40O2","C01607","4760"
"Neurosporene","C40H58","C05431","7795"
"Salonitenolide","C15H20O4","C09542","11733"
"4-Chloroacetanilide","C8H8ClNO","C14494","154175"
"Ridentin","C15H20O4","C09540","11731"
"Isoboldine","C19H21NO4","C09541","11732"
"Quing Hau Sau","C15H22O5","C09538","11729"
"Senkirkine","C19H27NO6","C10396","12582"
"Pyrethrosin","C17H22O5","C09536","11727"
"Quadrone","C15H20O3","C09537","11728"
"Purpurin 1-methyl ether","C15H10O5","C10397","12583"
"Santamarin","C15H20O3","C09544","11735"
"beta-Santonin","C15H18O3","C09545","11736"
"Bromochloromethane","CH2BrCl","C02661","5634"
"Coniferyl aldehyde","C10H10O3","C02666","5637"
"Rofecoxib","C17H14O4S","C07590","9792"
"Chlorobiphenyl-desleucyl-vancomycin","C72H71Cl3N8O23","C12036","14191"
"6-Acetyl-D-glucose","C8H14O7","C02655","5628"
"6-Carboxyhexanoate","C7H12O4","C02656","5629"
"4-Hydroxy-2-butynal","C4H4O2","C02648","5625"
"5-Dehydroshikimate","C7H8O5","C02652","5626"
"Acetone cyanohydrin","C4H7NO","C02659","5632"
"Benzyl thiocyanate","C8H7NS","C02660","5633"
"6-Methylsalicylate","C8H8O3","C02657","5630"
"Acetaldehyde oxime","C2H5NO","C02658","5631"
"Ryanodine","C25H35NO9","C08705","10898"
"Ufenamate","C18H18F3NO2","C13293","586037"
"AHBA","C7H7NO3","C12107","14254"
"Gonadorelin","C55H75N17O13","C07607","9809"
"S-(4-Azidophenacyl)glutathione","C18H22N6O7S","C11315","13490"
"Ginkgolide J","C20H24O10","C07604","9806"
"Brompheniramine","C16H19BrN2","C06857","9075"
"Budesonide","C25H34O6","C06858","9076"
"Bretylium","C11H17BrN+","C06855","9073"
"Bilobalide","C15H18O8","C07605","9807"
"Buspirone","C21H31N5O2","C06861","9079"
"Busulfan","C6H14O6S2","C06862","9080"
"Bumetanide","C17H20N2O5S","C06859","9077"
"Bupropion","C13H18ClNO","C06860","9078"
"omega-Cycloheptylundecanoic acid","C18H34O2","C12103","14250"
"Butorphanol","C21H29NO2","C06863","9081"
"Calcitonin","C145H240N44O48S2","C06865","9082"
"FK520","C43H69NO12","C12102","14249"
"Capillarisin","C16H12O7","C08999","11191"
"Thiotropocin","C8H4O3S2","C12105","14252"
"Cannabichromene","C21H30O2","C08998","11190"
"Cycloheptanecarboxylic acid","C8H14O2","C12104","14251"
"D-Valine","C5H11NO2","C06417","8652"
"5,7-Dihydroxychromone","C9H6O4","C09001","11193"
"alpha-D-Glucose 3-phosphate","C6H13O9P","C03811","6558"
"Stearoylglycerone phosphate","C21H41O7P","C03805","6554"
"Cimifugin","C16H18O6","C09000","11192"
"Pantothenol","C9H19NO4","C05944","8228"
"N,6-O-Disulfo-D-glucosamine","C6H13NO11S2","C03789","6538"
"Aurasperone D","C31H24O10","C08995","11187"
"N6,N6,N6-Trimethyl-L-lysine","C9H20N2O2","C03793","6542"
"N-(Carboxymethyl)-D-alanine","C5H9NO4","C03790","6539"
"N6-Methyl-2'-deoxyadenosine","C11H15N5O3","C03795","6544"
"Balfourodine","C16H19NO4","C10647","12830"
"S-Methyl-1-thio-D-glycerate","C4H8O3S","C03804","6553"
"Aloesin","C19H22O9","C08994","11186"
"N-Monomethyl-2-aminoethylphosphonate","C3H10NO3P","C05679","7986"
"2-Oxo-4-hydroxy-5-aminovalerate","C5H9NO4","C05941","8226"
"Butyrylmallotochromene","C26H30O8","C08997","11189"
"beta-Nitropropanoate","C3H5NO4","C05669","7977"
"Bucharaine","C19H25NO4","C10649","12832"
"Precorrin 5","C45H54N4O17","C06416","8651"
"Biflorin","C16H18O9","C08996","11188"
"CMP-N-trimethyl-2-aminoethylphosphonate","C14H27N4O10P2+","C05674","7981"
"1-Hydroxy-2-aminoethylphosphonate","C2H8NO4P","C05678","7985"
"2-Amino-3-phosphonopropanoate","C3H8NO5P","C05672","7979"
"CMP-2-aminoethylphosphonate","C11H20N4O10P2","C05673","7980"
"2(1H)-Quinolinone","C9H7NO","C06415","8650"
"Bucharidine","C19H25NO4","C10652","12835"
"D-Histidine","C6H9N3O2","C06419","8654"
"Encelin","C15H16O3","C09404","11595"
"Enhydrin","C23H28O10","C09405","11596"
"D-Glucurono-6,2-lactone","C6H8O6","C03387","6220"
"D-Galactose 1-phosphate","C6H13O9P","C03384","6219"
"Bilirubin-glucuronoside","C39H44N4O12","C03374","6209"
"Aminoimidazole ribotide","C8H14N3O7P","C03373","6208"
"D-Galactono-1,4-lactone","C6H10O6","C03383","6218"
"Bis(3-aminopropyl)amine","C6H17N3","C03375","6210"
"Elephantin","C20H22O7","C09402","11593"
"5-O-Methyl-myo-inositol","C7H14O6","C03365","6202"
"7''-O-Phosphohygromycin","C20H38N3O16P","C03368","6205"
"6-alpha-Maltosylglucose","C18H32O16","C03367","6204"
"Rhododendrin","C16H24O7","C09965","12151"
"Atalanine","C34H30N2O9","C10644","12827"
"Arborinine","C16H15NO4","C10643","12826"
"D-Isoleucine","C6H13NO2","C06418","8653"
"Robustadial A","C23H30O5","C09966","12152"
"Lactaldehyde","C3H6O2","C05999","8273"
"(S)-3-Hydroxyisobutyryl-CoA","C25H44N7O18P3S","C06000","8274"
"3-Hydroxyisopentyl-CoA","C26H48N7O17P3S","C05997","8271"
"3-Hydroxyisovaleryl-CoA","C26H46N7O18P3S","C05998","8272"
"2-Propylmalate","C7H12O5","C05994","8268"
"Taxifolin 3-O-acetate","C17H14O8","C09967","12153"
"Isoscoparine","C22H22O11","C05990","8266"
"Acetyl adenylate","C12H16N5O8P","C05993","8267"
"Robustaol A","C25H30O9","C09968","12154"
"Gentianamine","C11H11NO3","C09961","12147"
"3-Hydroxy-2-methyl-[R-(R,S)]-butanoic acid","C5H10O3","",""
"Gentioflavine","C10H11NO3","C09962","12148"
"Chaulmoogric acid","C18H32O2","C08282","10480"
"Docosanoic acid","C22H44O2","C08281","10479"
"gamma-Hydroxy-L-arginine","C6H14N4O3","C08284","10482"
"Homostachydrine","C8H15NO2","C08283","10481"
"Suberic acid","C8H14O4","C08278","10476"
"alpha-Cubebene","C15H24","C09647","11837"
"L-gamma-Glutamyl-L-hypoglycin","C12H18N2O5","C08280","10478"
"Tiglic acid","C5H8O2","C08279","10477"
"beta-Cubebene","C15H24","C09648","11838"
"(+)-gamma-Hydroxy-L-homoarginine","C7H16N4O3","C08286","10484"
"10,16-Dihydroxyhexadecanoic acid","C16H32O4","C08285","10483"
"Resiniferatoxin","C37H40O9","C09179","11371"
"Resiniferonol","C20H28O6","C09178","11370"
"Chartreusin","C32H32O14","C09181","11373"
"Precorrin 8X","C45H60N4O14","C06408","8643"
"Rhodojaponin IV","C24H38O8","C09180","11372"
"N-Acetyl-D-muramoate","C11H19NO8","C05887","8175"
"Portulal","C20H32O4","C09175","11367"
"Ponalactone A","C19H22O6","C09174","11366"
"Premarrubiin","C20H28O4","C09177","11369"
"Alloxanthine","C5H4N4O2","C07599","9801"
"Eseridine","C15H21N3O3","C09176","11368"
"Tribenoside","C29H34O6","C12492","582882"
"Pyrrolnitrin","C10H6Cl2N2O2","C12491","582881"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-sn-glycerol3'-phosphate","C40H78O13P2","C13885","854130"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-sn-glycerol","C40H77O10P","C13883","854128"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoserine","C40H76NO10P","C13880","854125"
"Tulobuterol","C12H18ClNO","C13879","854124"
"Cetylpyridinium chloride","C21H40ClNO","C11307","13482"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine","C39H76NO8P","C13877","854122"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphonocholine","C42H83NO7P+","C13876","854121"
"Pamicogrel","C25H24N2O4S","C12487","582877"
"4-Quinolinecarboxylic acid","C10H7NO2","C06414","8649"
"Caldarchaeol","C86H172O6","C13872","854117"
"Pemirolast potassium","C10H7KN6O","C12485","582875"
"Phenylethyl alcohol","C8H10O","C05853","8146"
"(9Z,12Z)-(7S,8S)-Dihydroxyoctadeca-9,12-dienoic acid","C18H32O4","C07354","9559"
"3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one","C11H14O4","C07350","9557"
"Oxaprozin","C18H15NO3","C07356","9561"
"(9Z)-(7S,8S)-Dihydroxyoctadecenoic acid","C18H34O4","C07355","9560"
"Oxazepam","C15H11ClN2O2","C07359","9563"
"(9Z,12Z,15Z)-(7S,8S)-Dihydroxyoctadeca-9,12,15-trienoic acid","C18H30O4","C07357","9562"
"Piperacillin sodium","C23H26N5NaO7S","C07361","9565"
"Oxybutynin","C22H31NO3","C07360","9564"
"D1927","C21H36N4O5S","C11717","13882"
"Pipobroman","C10H16Br2N2O2","C07362","9566"
"Lucanthone","C20H24N2OS","C11715","13880"
"Mirasan","C13H21ClN2","C11716","13881"
"beta-Naphthol","C10H8O","C11713","13878"
"Spiredine","C22H27NO3","C08711","10904"
"Trazodone","C19H22ClN5O","C07156","9365"
"Teprotide","C53H76N14O12","C11712","13877"
"Isoallolithocholic acid","C24H40O3","","81304"
"L-Xylonate","C5H10O6","C05411","7777"
"2,2',5,5'-Tetrachlorobiphenyl","C12H6Cl4","C14199","7847009"
"4-tert-Butylphenol","C10H14O","C14200","7847010"
"2,2',4,4',5,5'-Hexachlorobiphenyl","C12H4Cl6","C14201","7847011"
"2,2',4,4',6,6'-Hexachlorobiphenyl","C12H4Cl6","C14202","7847012"
"2,2',3,3',5,5'-Hexachloro-6-biphenylol","C12H4Cl6O","C14203","7847013"
"Gulono-1,4-lactone","C6H10O6","C05410","7776"
"4-tert-Octylphenol","C14H22O","C14205","7847015"
"M1","C12H11Cl2NO4","C14206","7847016"
"M2","C11H11Cl2NO2","C14207","7847017"
"Promegestone","C22H30O2","C14208","7847018"
"1-Methyl-4-phenylpyridinium","C12H12N+","C11310","13485"
"D-Allothreonine","C4H9NO3","C12317","582707"
"Caryoptin","C26H36O9","C09070","11262"
"6-Chlorobenzene-1,2,4-triol","C6H5ClO3","C06328","8564"
"2-Methyl-3-ketovaleric acid","C6H10O3","","766532"
"Diflubenzuron","C14H9ClF2N2O2","C14427","178535"
"2b,3a,7a-Trihydroxy-5b-cholanoic acid","C24H40O5","",""
"2-Hydroxy-3-methylbutyric acid","C5H10O3","","283155"
"2,8-Dihydroxyadenine","C5H5N5O2","","669132"
"2-Hydroxyadenine","C5H5N5O","","653970"
"1,6-Dinitropyrene","C16H8N2O4","C14424","180241"
"2-sec-Butylphenyl N-methylcarbamate","C12H17NO2","C14425","162493"
"L-Rhamnofuranose","C6H12O5","C02431","5458"
"Dichlorvos","C4H7Cl2O4P","C14430","149015"
"Methidathion","C6H11N2O4PS3","C14431","157045"
"3-Hydroxy-2-methyl-[S-(R,R)]-butanoic acid","C5H10O3","",""
"3a,12b-Dihydroxy-5b-cholanoic acid","C24H40O4","","3727523"
"Sinapyl alcohol","C11H14O4","C02325","5377"
"Salicyl alcohol","C7H8O2","C02323","5375"
"UDP-L-iduronate","C15H22N2O18P2","C02330","5380"
"Tolmetin sodium","C15H18NNaO5","C02328","5379"
"Phenylhydrazine","C6H8N2","C02304","5358"
"N-Methylaniline","C7H9N","C02299","5354"
"Prostaglandin F2beta","C20H34O5","C02314","5368"
"Phosphocreatine","C4H10N3O5P","C02305","5359"
"Germacrene B","C15H24","C09672","11862"
"Xanthopterin-B2","C9H10N4O4","C02333","5383"
"Vinylacetyl-CoA","C25H40N7O17P3S","C02331","5381"
"(2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate","C8H15NO4","C06326","8562"
"Sulfisomidine","C12H14N4O2S","C12977","583366"
"Gefarnate","C27H44O2","C12980","583369"
"Cefroxadine","C16H19N3O5S","C12979","583368"
"Mestanolone","C20H32O2","C12984","583373"
"dl-alpha-Tocopherol nicotinate","C35H53NO3","C12981","583370"
"N2-Acetyl-L-aminoadipate","C8H13NO5","C12986","583375"
"Dromostanolone propionate","C23H36O3","C12985","583374"
"N2-Acetyl-L-aminoadipate semialdehyde","C8H13NO4","C12988","583377"
"N2-Acetyl-L-aminoadipyl-delta-phosphate","C8H14NO8P","C12987","583376"
"Heptopyranosides","C13H24O7","C02413","5446"
"Melibiose","C12H22O11","C05402","7769"
"Carthamone","C21H20O11","C08598","10791"
"Cucurbitacin O","C30H46O7","C08803","10996"
"Cucurbitacin P","C30H48O7","C08804","10997"
"Cucurbitacin E","C32H44O8","C08797","10990"
"Cucurbitacin F","C30H46O7","C08798","10991"
"Cucurbitacin C","C32H48O8","C08795","10988"
"Cucurbitacin D","C30H44O7","C08796","10989"
"Cucurbitacin J","C30H44O8","C08801","10994"
"Cucurbitacin L","C30H44O7","C08802","10995"
"Cucurbitacin H","C30H46O8","C08799","10992"
"Cucurbitacin I","C30H42O7","C08800","10993"
"Sulfamethopyrazine","C11H12N4O3S","C12616","583006"
"3-beta-D-Galactosyl-sn-glycerol","C9H18O8","C05401","7768"
"Lactucaxanthin","C40H56O2","C08599","10792"
"Diacetyl","C4H6O2","C00741","4004"
"Macrocin","C45H75NO17","C00744","4006"
"Nicotine","C10H14N2","C00745","4007"
"Oxytocin","C43H66N12O12S2","C00746","4008"
"Pyridine","C5H5N","C00747","4009"
"Siroheme","C42H44FeN4O16","C00748","4010"
"Sucrose","C12H22O11","C00089","3389"
"Squalene","C30H50","C00751","4013"
"D-Fructose 6-phosphate","C6H13O9P","C00085","3385"
"Epimelibiose","C12H22O11","C05400","7767"
"Malonyl-CoA","C24H38N7O19P3S","C00083","3383"
"Acetaldehyde","C2H4O","C00084","3384"
"ITP","C10H15N4O14P3","C00081","3381"
"L-Tyrosine","C9H11NO3","C00082","3382"
"L-Tryptophan","C11H12N2O2","C00078","3378"
"L-Phenylalanine","C9H11NO2","C00079","3379"
"N5-Methyl-L-glutamine","C6H12N2O3","C03153","6041"
"N-Ribosylnicotinamide","C11H15N2O5+","C03150","6038"
"N-Phosphotaurocyamine","C3H10N3O6PS","C03149","6037"
"N-Malonylanthranilate","C10H9NO5","C03147","6035"
"Phenanthrene-3,4-diol","C14H10O2","C03164","6048"
"2-Succinylbenzoyl-CoA","C32H44N7O20P3S","C03160","6045"
"O-Feruloylgalactarate","C16H18O11","C03156","6043"
"N6'-Acetylkanamycin-B","C20H39N5O11","C03154","6042"
"Astaxanthin","C40H52O4","C08580","10773"
"Azafrin","C27H38O4","C08581","10774"
"Phosphonoacetaldehyde","C2H5O4P","C03167","6050"
"Phosphoguanidinoacetate","C3H8N3O5P","C03166","6049"
"Aureusidin","C15H10O6","C08576","10769"
"Bracteatin","C15H10O7","C08577","10770"
"Apigeninidin","C15H11O4+","C08574","10767"
"Aurantinidin","C15H11O6+","C08575","10768"
"Lutein","C40H56O2","C08601","10794"
"Dihydrosanguinarine","C20H15NO4","C05191","7596"
"12-Hydroxydihydrochelirubine","C21H17NO6","C05193","7598"
"Protopine","C20H19NO5","C05189","7594"
"Agathisflavone","C30H18O10","C10017","12203"
"(R)-Reticuline","C19H23NO4","C05178","7589"
"Salutaridine","C19H21NO4","C05179","7590"
"(S)-N-Methylcoclaurine","C18H21NO3","C05176","7587"
"Sativanine B","C30H38N4O4","C10013","12199"
"Apigenin 7-(6''-malonylglucoside)","C24H22O13","C10020","12206"
"Apigenin 7,4'-dimethyl ether","C17H14O5","C10019","12205"
"Dihydrochelirubine","C21H17NO5","C05194","7599"
"3-Hydroxybenzoyl-CoA","C28H40N7O18P3S","C05195","7600"
"Flavoxanthin","C40H56O3","C08594","10787"
"alpha-D-Hexose 1-phosphate","C6H13O9P","C01171","4398"
"Capensinidin","C18H17O7+","C08595","10788"
"2,3-Dihydroxy-3-methylbutanoate","C5H10O4","C04039","6741"
"1-Oxa-2-oxo-3-hydroxycycloheptane","C6H10O3","C12314","582705"
"Helenien","C72H116O4","C08597","10790"
"3-hydroxy-4-phospho-hydroxy-alpha-ketobutyrate","C4H6O8P-","",""
"Isorhapontin","C21H24O9","C10266","12452"
"Sucralose","C12H19Cl3O8","C12285","14429"
"Saccharin sodium anhydrous","C7H4NNaO3S","C12284","14428"
"Saccharin","C7H5NO3S","C12283","14427"
"Methyl acetyl ricinoleate","C21H38O4","C12280","14424"
"Copper gluconate","C12H22CuO14","C12278","14422"
"Ferrous gluconate","C12H26FeO16","C12274","14418"
"N-Oleoyl dopamine","C26H43NO3","C12272","14417"
"Arachidonoyl dopamine","C28H41NO3","C12271","14416"
"3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione","C19H24O4","C04793","7356"
"3-(4-Deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine","C14H21NO11","C04794","7357"
"Cyanidin-3-O-[D-rhamnosyl-1,6-D-glucoside]-5-O-D-glucoside","C33H43ClO20","C04787","7350"
"Lysosomal-enzyme N-acetyl-D-glucosaminyl-phospho-D-mannose","C14H26NO14P","C04789","7352"
"5-Amino-4-chloro-2-(2,3-dihydroxyphenyl)-3(2H)-pyridazinone","C10H8ClN3O3","C04798","7360"
"UDP-N-acetylmuramoyl-L-Ala-D-gamma-Glu-6-carboxy-L-Lys-D-Ala","C37H58N8O27P2","C04804","7366"
"beta-Ionone","C13H20O","C12287","14431"
"5-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde","C9H11NO6","C04797","7359"
"2-Fluorobenzoyl-CoA","C28H39FN7O17P3S","C02784","5735"
"1-O-(1Z-Tetradecenyl)-2-(9Z-octadecenoyl)-sn-glycerol","C35H66O4","C13864","854109"
"Stramonin B","C15H18O4","C09552","11743"
"Stanozolol","C21H32N2O","C07311","9519"
"2-Acetamidofluorene","C15H13NO","C02778","5729"
"Spironolactone","C24H32O4S","C07310","9518"
"Lysergic acid","C16H16N2O2","C07541","9744"
"Lysergic acid diethylamide","C20H25N3O","C07542","9745"
"Ethylmorphine","C19H23NO3","C07537","9740"
"Benzphetamine","C17H21N","C07538","9741"
"Aminopyrine","C13H17N3O","C07539","9742"
"6-Methylergoline","C15H18N2","C07540","9743"
"Prenalterol","C12H19NO3","C07533","9736"
"Ethynyl estradiol","C20H24O2","C07534","9737"
"Benzpyrene","C20H12","C07535","9738"
"Amobarbital","C11H18N2O3","C07536","9739"
"Suxibuzone","C24H26N2O6","C12718","583108"
"Nicergoline","C24H26BrN3O3","C12720","583109"
"Carindacillin sodium","C26H25N2NaO6S","C12712","583102"
"Bisbentiamine","C38H42N8O6S2","C12713","583103"
"Flutazolam","C19H18ClFN2O3","C12715","583105"
"Dimefline hydrochloride","C20H22ClNO3","C12717","583107"
"Droxidopa","C9H11NO5","C12706","583096"
"Oxazolam","C18H17ClN2O2","C12707","583097"
"Flutoprazepam","C19H16ClFN2O","C12708","583098"
"Cyclofenil","C23H24O4","C12710","583100"
"Terpinolene","C10H16","C06075","8341"
"Myrcene","C10H16","C06074","8340"
"3-Oxo-delta5-steroid","C19H28O","C01034","4277"
"Dimethylallyltryptophan","C16H20N2O2","C06067","8334"
"3-Aminopropane-1,2-diol","C3H9NO2","C06057","8327"
"4-Hydroxy-L-threonine","C4H9NO4","C06056","8326"
"O-Phospho-4-hydroxy-L-threonine","C4H10NO7P","C06055","8325"
"Deoxyloganin","C17H26O9","C06071","8338"
"Iridotrial","C10H14O3","C06070","8337"
"Iridodial","C10H16O2","C06069","8336"
"Elymoclavine","C16H18N2O","C06068","8335"
"Yersiniabactin","C21H27N3O4S3","C12038","14193"
"Licarin A","C20H22O4","C10650","12833"
"6beta,7beta-Dihydroxykaurenoic acid","C20H30O4","C11876","14038"
"Retinal","C20H28O","C00376","3666"
"Gibberellin A34-catabolite","C19H22O6","C11869","14031"
"Gibberellin A34","C19H24O6","C11868","14030"
"dGMP","C10H14N5O7P","C00362","3653"
"SN38 glucuronide","C28H28N2O11","C11376","13550"
"dTMP","C10H15N2O8P","C00364","3655"
"dTDP","C10H16N2O11P2","C00363","3654"
"Spicatin","C27H32O10","C09551","11742"
"Gibberellin A5","C19H22O5","C11871","14033"
"Zeatin","C10H13N5O","C00371","3661"
"Sterol","C17H28O","C00370","3660"
"Triacetylene","C6H2","C08463","10656"
"Gibberellin A8-catabolite","C19H22O7","C11870","14032"
"4,4-Dimethyl-14a-formyl-5a-cholesta-8,24- dien-3b-ol","C30H48O2","","709482"
"Cotinine N-oxide","C10H12N2O2","","585021"
"Tridec-1-ene-3,5,7,9,11-pentayne","C13H6","C08464","10657"
"Cotinine methonium ion","C11H15N2O","","585040"
"Gibberellin A51","C19H24O5","C11865","14027"
"Hydroxycotinine","C10H12N2O2","","308021"
"Triparanol","C7H13NO2","","300962"
"N'-Hydroxymethylnorcotinine","C10H12N2O2","","585024"
"N5-Carboxyaminoimidazole ribonucleotide","C9H13N3O9P","","2527"
"2-Keto-3-deoxy-D-gluconic acid","C6H10O6","","738733"
"Gibberellin A4","C19H24O5","C11864","14026"
"Tricornine","C27H43NO8","C08715","10908"
"Gibberellin A7","C19H22O5","C11867","14029"
"Maritimetin","C15H10O6","C08720","10913"
"Kaur-16-en-18-oic acid","C20H30O2","C11874","14036"
"2,3-Dehydro-gibberellin A9","C19H22O4","C11866","14028"
"4,5-Methylenedioxy-6-hydroxyaurone","C16H10O5","C08722","10915"
"Malvin","C29H35O17+","C08718","10911"
"Sophoranone","C30H36O4","C08719","10912"
"N-Acetylneuraminate","C11H19NO9","C00270","3568"
"Dihydrobiopterin","C9H13N5O3","C00268","3566"
"ent-7alpha-Hydroxykaur-16-en-19-oic acid","C20H30O3","C11875","14037"
"Glycolaldehyde","C2H4O2","C00266","3564"
"Dithiothreitol","C4H10O2S2","C00265","3563"
"L-Homoserine","C4H9NO3","C00263","3561"
"Hypoxanthine","C5H4N4O","C00262","3560"
"Benzaldehyde","C7H6O","C00261","3559"
"L-Arabinose","C5H10O5","C00259","3558"
"D-Glycerate","C3H6O4","C00258","3557"
"Neoabietadiene","C20H32","C11880","14042"
"Ludovicin A","C15H20O4","C09498","11689"
"Magnolol","C18H18O2","C10651","12834"
"Scopolin","C16H18O9","C01527","4689"
"Ricinine","C8H8N2O2","C01526","4688"
"Pregnane","C21H36","C01523","4686"
"Nigerose","C12H22O11","C01518","4683"
"Naproxen","C14H14O3","C01517","4682"
"Morphine","C17H19NO3","C01516","4681"
"Luteolin","C15H10O6","C01514","4680"
"Lupinate","C13H18N6O3","C01513","4679"
"a-N-Acetylglucosamine","C8H15NO6","","256156"
"Acetylglycine","C4H7NO3","","249208"
"3-Hydroxyvaleric acid","C5H10O3","","738428"
"6-Ketoestriol","C18H22O4","",""
"8-Hydroxyadenine","C5H5N5O","","85805"
"7b-Hydroxy-3-oxo-5b-cholanoic acid","C24H38O4","",""
"Sulindac","C20H17FO3S","C01531","4693"
"Octadecanoic acid","C18H36O2","C01530","4692"
"Anthemis glycoside A","C39H49NO21","C08326","10524"
"Amygdalin","C20H27NO11","C08325","10523"
"Etoposide","C29H32O13","C01576","4733"
"Flavonoid","C15H12O2","C01579","4735"
"D-Leucine","C6H13NO2","C01570","4727"
"Decanoic acid","C10H20O2","C01571","4728"
"Digallate","C14H10O9","C01572","4729"
"Ephedrine","C10H15NO","C01575","4732"
"(9Z)-Tetradecenoic acid","C14H26O2","C08322","10520"
"Malvalic acid","C18H32O2","C08321","10519"
"Cytomycin","C17H23N7O5","C01567","4724"
"(15Z)-Tetracosenoic acid","C24H46O2","C08323","10521"
"(-)-Abietadiene","C20H32","C11878","14040"
"Levopimaradiene","C20H32","C11879","14041"
"Chloramphenicol palmitate","C27H42Cl2N2O6","C11726","13891"
"Indaconitine","C34H47NO10","C08691","10884"
"trans-2-hexenol","C6H12O","","156915"
"Clonazepam","C15H10ClN3O3","C06919","9136"
"Quinoline","C9H7N","C06413","8648"
"(-)-Pellotine","C13H19NO3","C09604","11795"
"Xerantholide","C15H18O3","C09605","11796"
"4-(Dimethylamino)azobenzene","C14H15N3","C03764","6520"
"3-Imidazole-2-oxopropanoate","C6H6N2O3","C03762","6519"
"Vulgarin","C15H20O4","C09600","11791"
"Xanthatin","C15H18O3","C09601","11792"
"Xanthinin","C17H22O5","C09602","11793"
"Xanthumin","C17H22O5","C09603","11794"
"Obaberine","C38H42N2O6","C09596","11787"
"Ochotensine","C21H21NO4","C09597","11788"
"Oxyacanthine","C37H40N2O6","C09598","11789"
"Parfumine","C20H19NO5","C09599","11790"
"3-Methylindolepyruvate","C12H11NO3","C05644","7955"
"4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoate","C10H9NO5","C05645","7956"
"5-Hydroxyindolepyruvate","C11H9NO4","C05646","7957"
"Formyl-5-hydroxykynurenamine","C10H12N2O3","C05647","7958"
"5-Hydroxy-N-formylkynurenine","C11H12N2O5","C05648","7959"
"Dihydropteridine","C6H6N4","C05649","7960"
"Tetrahydropteridine","C6H8N4","C05650","7961"
"5-Hydroxykynurenine","C10H12N2O4","C05651","7962"
"4-(2-Amino-5-hydroxyphenyl)-2,4-dioxobutanoate","C10H9NO5","C05652","7963"
"Formylanthranilate","C8H7NO3","C05653","7964"
"Actinidine","C10H13N","C09910","12096"
"Thymyl acetate","C12H16O2","C09909","12095"
"Eupachlorin","C20H25ClO7","C09416","11607"
"Eupachlorin acetate","C22H27ClO8","C09417","11608"
"Daphnoline","C35H36N2O6","C09418","11609"
"Dauricine","C38H44N2O6","C09419","11610"
"Emetamine","C29H36N2O4","C09420","11611"
"Emetine","C29H40N2O4","C09421","11612"
"Erysonine","C17H19NO3","C09422","11613"
"Erysotrine","C19H23NO3","C09423","11614"
"Erythratidine","C19H25NO4","C09424","11615"
"Eupachloroxin","C20H25ClO8","C09425","11616"
"5-(4-Hydroxy-but-1-ynyl)-2,2'-bithiophene","C12H10OS2","C04486","7105"
"5-(4-Acetoxybut-1-ynyl)-2,2'-bithiophene","C14H12O2S2","C04485","7104"
"Deoxypeganine","C11H12N2","C10656","12839"
"Cusparine","C19H17NO3","C10655","12838"
"Magnoshinin","C24H30O6","C10658","12841"
"Magnosalicin","C24H32O7","C10657","12840"
"Dictamnine","C12H9NO2","C10660","12843"
"Deoxyvasicinone","C11H10N2O","C10659","12842"
"3-Methoxyapigenin","C16H12O6","C05902","8190"
"Dubamine","C16H11NO2","C10661","12844"
"Acetosyringone","C10H12O4","C10664","12847"
"Echinopsine","C10H9NO","C10663","12846"
"Delphinidin","C15H11O7+","C05908","8196"
"Leucodelphinidin","C15H14O8","C05909","8197"
"Cloxacillin","C19H18ClN3O5S","C06923","9140"
"Serratine","C16H25NO3","C09901","12087"
"8-Demethyltetracenomycin C","C22H18O11","C12379","582769"
"Geraniin","C41H28O27","C10230","12416"
"Guibourtinidol-(4alpha->6)-catechin","C30H26O10","C10231","12417"
"[Epicatechin-(4beta->8)]5-epicatechin","C90H74O36","C10222","12408"
"Epigallocatechin-(4beta->8)-epicatechin-3-O-gallate ester","C37H30O17","C10223","12409"
"Eugeniin","C41H30O26","C10224","12410"
"ent-Fisetinidol-(4beta->8)-catechin-(6->4beta)-ent-fisetinidol","C45H38O16","C10225","12411"
"Fucofuroeckol B","C24H14O11","C10226","12412"
"Gallocatechin-(4alpha->8)-epigallocatechin","C30H26O14","C10227","12413"
"Gambiriin C","C30H26O11","C10228","12414"
"Gemin A","C82H56O52","C10229","12415"
"Indolepyruvate","C11H9NO3","C00331","3625"
"Deoxyguanosine","C10H13N5O4","C00330","3624"
"Premithramycin A3'","C40H50O18","C12386","582776"
"D-Glucosamine","C6H13NO5","C00329","3623"
"Cyclohexyl isocyanide","C7H11N","C11520","13688"
"UDP-6-sulfoquinovose","C15H23N2O19P2S-","C11521","13689"
"24-Methylene lophenol","C29H48O","C11522","13690"
"24-Ethylidene lophenol","C30H50O","C11523","13691"
"5-PP-InsP5","C6H19O27P7","C11526","13694"
"4-Hydroxymandelate","C8H8O4","C11527","13695"
"6-O-(beta-D-Xylopyranosyl)-beta-D-glucopyranose","C11H20O10","C11535","13702"
"(2R)-2-Phospho-3-sulfolactate","C3H7O9PS","C11536","13703"
"(2R)-3-Sulfolactate","C3H6O6S","C11537","13704"
"Cobalt-precorrin 2","C42H46CoN4O16+","C11538","13705"
"4-Aminobutanoate","C4H9NO2","C00334","3628"
"D-Galacturonate","C6H10O7","C00333","3627"
"Acetoacetyl-CoA","C25H40N7O18P3S","C00332","3626"
"2-Arachidonoylglycerol","C23H38O4","C13856","854101"
"1-Dodecanoyl-sn-glycerol","C15H30O4","C13854","854099"
"1-O-Octadecyl-sn-glycerol","C21H44O3","C13858","854103"
"1-Arachidonoylglycerol","C23H38O4","C13857","854102"
"BRL 32872","C29H36ClN3O7","C13851","854096"
"Albuterol","C13H21NO3","C13850","854095"
"L 735821","C25H19Cl2N3O2","C13853","854098"
"Sipatrigine","C15H16Cl3N5","C13852","854097"
"N-Phospho-D-lombricine","C6H16N4O9P2","C02855","5793"
"1-O-Octadec-9-enyl glycerol","C21H42O3","C13860","854105"
"1-O-Hexadecyl-sn-glycerol","C19H40O3","C13859","854104"
"L-Metanephrine","C10H15NO3","C05588","7913"
"6-Acetylmorphine","C19H21NO4","C11781","13945"
"Dihydromorphine","C17H21NO3","C11782","13946"
"Minovincinine","C21H26N2O3","C11783","13947"
"Echitovenine","C23H28N2O4","C11784","13948"
"Maltol","C6H6O3","C11918","14079"
"3-Acetylmorphine","C19H21NO4","C11778","13942"
"Heterocodeine","C18H21NO3","C11779","13943"
"6-Ethylmorphine","C19H23NO3","C11780","13944"
"Normorphine","C16H17NO3","C11785","13949"
"Morphine N-oxide","C17H19NO4","C11786","13950"
"Perillic acid","C10H14O2","C11924","14085"
"dTDP-3-amino-3,6-dideoxy-D-glucose","C16H27N3O14P2","C11925","14086"
"Bisphenol B","C16H18O2","C14225","7847035"
"p-tert-Amylphenol","C11H16O","C14226","7847036"
"Phenolphthalin","C20H16O4","C14223","7847033"
"4-Hydroxybiphenyl","C12H10O","C14224","7847034"
"6-Hydroxyflavanone","C15H12O3","C14221","7847031"
"Chrysene","C18H12","C14222","7847032"
"2-Chlorophenol","C6H5ClO","C14219","7847029"
"4,4'-Dihydroxybenzophenone","C13H10O3","C14220","7847030"
"Di-n-octyl phthalate","C24H38O4","C14227","7847037"
"Methyl parathion","C8H10NO5PS","C14228","7847038"
"alpha-Copaene","C15H24","C09639","11829"
"Violaxanthin","C40H56O4","C08614","10807"
"Chloramphenicol succinate","C15H16Cl2N2O8","C11727","13892"
"Midecamycin acetate","C45H71NO17","C13096","585160"
"Piretanide","C17H18N2O5S","C13094","585158"
"Enocitabine","C31H55N3O6","C13093","585157"
"Dexamethasone propionate","C28H37FO7","C13092","585156"
"Pentagastrin","C37H49N7O9S","C13091","585155"
"Propentofylline","C15H22N4O3","C13090","585154"
"Cefetamet pivoxil hydrochloride","C20H26ClN5O7S2","C13089","585153"
"Cefditoren pivoxil","C25H28N6O7S3","C13088","585152"
"Urate","C5H4N4O3","C00366","3657"
"Betamethasone dipropionate","C28H37FO7","C13097","585161"
"Obacunone","C26H30O7","C08775","10968"
"Picrasin C","C23H34O7","C08776","10969"
"Quassimarin","C26H34O11","C08777","10970"
"Quassin","C22H28O6","C08778","10971"
"Rutaevin","C26H30O9","C08779","10972"
"Salannin","C34H44O9","C08780","10973"
"Samaderin A","C18H18O6","C08781","10974"
"Sergeolide","C25H28O11","C08782","10975"
"Simalikilactone D","C25H34O9","C08783","10976"
"Soularubinone","C25H34O10","C08784","10977"
"dUMP","C9H13N2O8P","C00365","3656"
"Methylsalicyluric acid","C10H11NO4","","317691"
"3'-Phosphoadenylyl sulfate","C10H15N5O13P2S","C00053","3355"
"Adenosine 3',5'-bisphosphate","C10H15N5O10P2","C00054","3356"
"CMP","C9H14N3O8P","C00055","3357"
"Formate","CH2O2","C00058","3358"
"Glyoxylate","C2H2O3","C00048","3350"
"L-Aspartate","C4H7NO4","C00049","3351"
"Glutathione","C10H17N3O6S","C00051","3353"
"UDP-D-galactose","C15H24N2O17P2","C00052","3354"
"1,2-Diaminobenzene","C6H8N2","C14402","150293"
"2-Aminotoluene","C7H9N","C14403","150292"
"1,2,3-Trichloropropane","C3H5Cl3","C14400","150336"
"2,4-Diaminotoluene","C7H10N2","C14401","150312"
"FMN","C17H21N4O9P","C00061","3361"
"L-Arginine","C6H14N4O2","C00062","3362"
"4-(2,4-Dichlorophenoxy)butyric acid","C10H10Cl2O3","C14404","150255"
"N-Phenyl-1-naphthylamine","C16H13N","C14405","150031"
"Cinnamodial","C17H24O5","C09638","11828"
"Brunsvigine","C16H17NO4","C08519","10712"
"Candimine","C18H19NO6","C08520","10713"
"Caranine","C16H17NO3","C08521","10714"
"3-Acetylnerbowdine","C19H23NO6","C08514","10707"
"Albomaculine","C19H23NO5","C08515","10708"
"Amaryllisine","C18H23NO4","C08516","10709"
"Ambelline","C18H21NO5","C08517","10710"
"Caribine","C19H22N2O3","C08522","10715"
"Carinatine","C17H21NO4","C08523","10716"
"Palmatine","C21H22NO4+","C05315","7697"
"Dihydromacarpine","C22H19NO6","C05316","7698"
"Chlorophyll b","C55H70MgN4O6","C05307","7689"
"Linaloyl diphosphate","C10H20O7P2","C05308","7690"
"3-Hexaprenyl-4-hydroxy-5-methoxybenzoate","C38H56O4","C05313","7695"
"N-Methyl-(R,S)-tetrahydrobenzylisoquinoline","C17H19N","C05314","7696"
"16alpha-Hydroxyestrone","C18H22O3","C05300","7684"
"2-Hydroxyestradiol-17beta","C18H24O3","C05301","7685"
"2-Methoxyestradiol-17beta","C19H26O3","C05302","7686"
"Chlorophyll a","C55H72MgN4O5","C05306","7688"
"Lomefloxacin","C17H19F2N3O3","C07078","9289"
"Hygromycin B","C20H37N3O13","C01925","5031"
"1,2-Didecanoylglycerol","C23H44O5","C03199","6076"
"(S)-4-Hydroxymandelate","C8H8O4","C03198","6075"
"RU 5135","C18H28N2O2","C13797","854042"
"dTDP-6-deoxy-L-talose","C16H26N2O15P2","C03187","6066"
"Zinc protoporphyrin-9","C34H32N4O4Zn","C03184","6063"
"(+)-Bornyl-diphosphate","C10H20O7P2","C03190","6069"
"sn-Glyceryl phosphate","C3H9O6P","C03189","6068"
"(R)-10-Hydroxystearate","C18H36O3","C03195","6072"
"(R)-1-Aminopropan-2-ol","C3H9NO","C03194","6071"
"(S)-3-Hydroxybutanoate","C4H8O3","C03197","6074"
"(S)-2-Hydroxyglutarate","C5H8O5","C03196","6073"
"Populin","C20H22O8","C10823","13006"
"Coumermycin A1","C55H59N5O20","C05073","7522"
"Solasonine","C45H73NO16","C10824","13007"
"3-Dimethylallyl-4-hydroxyphenylpyruvate","C14H16O4","C12456","582846"
"Betulin","C30H50O2","C08618","10811"
"2,3-Bis(3-hydroxytetradecanoyl)-beta-D-glucosaminyl 1-phosphate","C34H66NO12P","C04824","7385"
"5-(3-Carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylate","C10H7NO7","C04826","7387"
"UDP-N-acetylmuramoyl-L-Ala-D-gamma-Glu-6-carboxy-L-Lys-(D-Ala)2","C40H63N9O28P2","C04828","7389"
"beta-D-Glucosyl-1,4-N-acetyl-D-glucosaminyldiphosphoundecaprenol","C69H115NO17P2","C04830","7391"
"2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one 2-D-glucoside","C15H19NO10","C04831","7392"
"Coenzyme M 7-mercaptoheptanoylthreonine-phosphate heterodisulfide","C13H26NO10PS3","C04832","7393"
"(2E,6E)-(10R,11S)-10,11-Epoxy-3,7,11-trimethyltrideca-2,6-dienoicacid","C16H26O3","C04834","7395"
"Chloroneb","C8H8Cl2O2","C11252","13429"
"3-O-(3,6-Anhydro-alpha-D-galactopyranosyl)-D-galactose 4-O-sulfate","C12H20O13S","C04839","7397"
"3beta-Hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylate","C29H48O3","C04840","7398"
"3-Nitrofluoranthene","C16H9NO2","C14406","156812"
"Calpeptin","C20H30N2O4","C11256","13433"
"Fawcettimine","C16H25NO2","C09864","12050"
"2-Amino-2-methyl-1,3-propandiol","C4H11NO2","C11260","13437"
"Bellendine","C12H15NO2","C10846","13029"
"trans-3-Chloroacrylic acid","C3H3ClO2","C06614","8840"
"3-Chloroallyl aldehyde","C3H3ClO","C06613","8839"
"Diethylphosphoric acid","C4H11O4P","C06608","8834"
"Diethylthiophosphoric acid","C4H11O3PS","C06607","8833"
"Paraoxon","C10H14NO6P","C06606","8832"
"Aminoparathion","C10H16NO3PS","C06605","8831"
"cis-3-Chloro-2-propene-1-ol","C3H5ClO","C06612","8838"
"trans-3-Chloro-2-propene-1-ol","C3H5ClO","C06611","8837"
"cis-1,3-Dichloropropene","C3H4Cl2","C06610","8836"
"trans-1,3-Dichloropropene","C3H4Cl2","C06609","8835"
"4-Nitroanisole","C7H7NO3","C07555","9758"
"1,4-Cyclohexanedione","C6H8O2","C08063","10263"
"Vecuronium","C34H57N2O4+","C07553","9756"
"Butoconazole","C19H17Cl3N2S","C08065","10265"
"(+)-2,7-Dideoxypancratistatin","C14H15NO6","C12256","14401"
"Butenafine","C23H27N","C08067","10267"
"Econazole","C18H15Cl3N2O","C08068","10268"
"Methitural","C12H20N2O2S2","C07558","9761"
"2-Bromo-5-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methoxy-N-methylbenzamide","C17H18BrNO4","C12252","14397"
"2-Iodo-6-methoxyphenol","C7H7IO2","C12251","14396"
"(+)-Plicamine","C26H26N2O6","C12254","14399"
"Norsanguinine","C15H17NO3","C12253","14398"
"5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate","C5H6N4O5","C12248","14393"
"Rifamycin W","C35H45NO11","C12247","14392"
"Anhydrolycorinone","C16H11NO3","C12250","14395"
"Kaempferol 3-O-glucoside","C21H20O11","C12249","14394"
"Metrizamide","C18H22I3N3O8","C12741","583130"
"Iodoxamic acid","C26H26I6N2O10","C12742","583131"
"Halcinonide","C24H32ClFO5","C12738","583127"
"Doxifluridine","C9H11FN2O5","C12739","583128"
"Bisibuthiamine","C32H46N8O6S2","C12750","583139"
"Molsidomine","C9H14N4O4","C12751","583140"
"Iobenzamic acid","C16H13I3N2O3","C12743","583132"
"Mexazolam","C18H16Cl2N2O2","C12746","583135"
"Zotepine","C18H18ClNOS","C12752","583141"
"Troleandomycin","C41H67NO15","C12753","583142"
"Veatchine","C22H33NO2","C06092","8358"
"Aconitine","C34H47NO11","C06091","8357"
"Gibberellin A53","C20H28O5","C06094","8360"
"Gibberellin A12 aldehyde","C20H28O3","C06093","8359"
"Gibberellin A29","C19H24O6","C06096","8362"
"Gibberellin A44 diacid","C20H28O6","C06095","8361"
"(+)-Limonene","C10H16","C06099","8364"
"Trihexyphenidyl","C20H31NO","C07171","9380"
"Adipate semialdehyde","C6H10O3","C06102","8366"
"Hexan-1-ol-6-oate","C6H10O3","C06101","8365"
"2-Chloronitrobenzene","C6H4ClNO2","C14407","149955"
"Methicillin","C17H20N2O6S","C07177","9386"
"Suramin","C51H40N6O23S6","C07974","10175"
"Imipramine hydrochloride","C19H25ClN2","C07982","10183"
"Metrifonate","C4H8Cl3O4P","C07971","10172"
"Piperazine","C4H10N2","C07973","10174"
"Diethylcarbamazine","C10H21N3O","C07968","10169"
"Ivermectin","C95H146O28","C07970","10171"
"Cerivastatin","C26H34FNO5","C07966","10167"
"Bithionol","C12H6Cl4O2S","C07967","10168"
"Tripelennamine","C16H21N3","C07180","9389"
"Linalyl acetate","C12H20O2","C09863","12049"
"Magnesium salicylate","C14H10MgO6","C07995","10196"
"Dehydroemetine","C29H38N2O4","C07996","10197"
"Calystegin B2","C7H13NO4","C10851","13034"
"Fibrin","C5H11N3O2","C00290","3584"
"HCO3-","CHO3-","C00288","3583"
"dGTP","C10H16N5O13P3","C00286","3581"
"EDTA","C10H16N2O8","C00284","3579"
"Sedoheptulose 7-phosphate","C7H15O10P","C00281","3576"
"Androst-4-ene-3,17-dione","C19H26O2","C00280","3575"
"D-Erythrose 4-phosphate","C4H9O7P","C00279","3574"
"D-Mannose 6-phosphate","C6H13O9P","C00275","3572"
"5-Dehydro-D-fructose","C6H10O6","C00273","3571"
"Tetrahydrobiopterin","C9H15N5O3","C00272","3570"
"Prenyl caffeate","C14H16O4","C10487","12670"
"Norchelerythrine","C20H15NO4","C12226","14371"
"6-Oxochelerythrine","C21H17NO5","C12225","14370"
"Purpureaside C","C35H46O20","C10488","12671"
"Myxochelin A","C20H24N2O7","C12220","14365"
"Corynebactin","C39H42N6O18","C12219","14364"
"Fe(CN)2","C2FeN2","C12218","14363"
"Fe(CN)3","C3FeN3","C12217","14362"
"N-Methyl-2,3,7,8-tetramethoxybenzophenanthridine-6(5H)-one","C22H21NO5","C12224","14369"
"N-Methyl-2,3,7,8-tetramethoxy-5,6-dihydrobenzophenathridine-6-ethanoic acid","C24H25NO6","C12223","14368"
"Hydroxysanguinarine","C20H13NO5","C12222","14367"
"Myxochelin B","C20H25N3O6","C12221","14366"
"Licoisoflavone A","C20H18O6","C10486","12669"
"Triforine","C10H14Cl6N4O2","C10960","13143"
"Salvianolic acid A","C26H22O10","C10492","12675"
"Tribenuron methyl","C15H17N5O6S","C10962","13145"
"Safrole","C10H10O2","C10490","12673"
"Ramoplanin A2","C119H154ClN21O40","C12008","14167"
"Telithromycin","C43H65N5O10","C12009","14168"
"(R)-3-(4-Hydroxyphenyl)lactate","C9H10O4","C03964","6685"
"DMG-MINO","C27H35N5O8","C12011","14169"
"Tigecycline","C29H39N5O8","C12012","14170"
"5,6-Dihydrouracil","C4H6N2O2","C00429","3718"
"Daptomycin","C72H101N17O26","C12013","14171"
"Mefruside","C13H19ClN2O5S2","C13349","586093"
"(24R)-24-Methylcycloarta-8,25-dien-3-beta-ol","C31H50O","C11513","13683"
"A47934","C58H44Cl3N7O21S","C12016","14173"
"Methyl jasmonate","C13H20O3","C11512","13682"
"MK826","C21H23N3O7S2","C12017","14174"
"(E)-2-(Methoxycarbonylmethyl)butenedioate","C7H8O6","C11515","13685"
"5-Tetradecenoic acid","C14H26O2","",""
"Carvedilol","C24H26N2O4","C06875","9092"
"3-Oxocholic acid","C24H38O5","","737114"
"(E)-3-(Methoxycarbonyl)pent-2-enedioate","C7H8O6","C11514","13684"
"Allocholic acid","C24H40O5","","738144"
"7a-Hydroxy-3-oxo-5b-cholanoic acid","C24H38O4","",""
"Senecioic acid","C5H8O2","","301842"
"2-(Biaryl)carbapenems","C21H19NO4","C12019","14176"
"Allochenodeoxycholic acid","C24H40O4","",""
"3beta-Hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carbaldehyde","C29H48O2","C11509","13679"
"4alpha-Methyl-5alpha-ergosta-8,14,24(28)-trien-3beta-ol","C29H46O","C11508","13678"
"3-Dehydroecdysone","C27H42O6","C02513","5523"
"3-Fumarylpyruvate","C7H6O6","C02514","5524"
"Syringin","C17H24O9","C01533","4695"
"Tyrosine","C9H11NO3","C01536","4697"
"1-Octanal","C8H16O","C01545","4704"
"2-Furoate","C5H4O3","C01546","4705"
"Propanethial S-oxide","C3H6OS","C08389","10585"
"Pentadecane","C15H32","C08388","10584"
"Octacosan-1-ol","C28H58O","C08387","10583"
"Nonacosan-10-one","C29H58O","C08386","10582"
"Nonacosan-10-ol","C29H60O","C08385","10581"
"Nonacosane","C29H60","C08384","10580"
"Methyl allyl disulfide","C4H8S2","C08383","10579"
"Lenthionine","C2H4S5","C08382","10578"
"Hexacosan-1-ol","C26H54O","C08381","10577"
"Heptan-2-one","C7H14O","C08380","10576"
"Proacaciberin","C16H25NO10","C08337","10535"
"Zierin","C14H17NO7","C08345","10542"
"Atractyloside","C30H44K2O16S2","C09064","11256"
"Callicarpone","C20H28O4","C09067","11259"
"Cafestol","C20H28O3","C09066","11258"
"(-)-Caaverine","C17H17NO2","C09368","11559"
"Quazepam","C17H11ClF4N2S","C07336","9543"
"Chasmanthin","C20H22O7","C09073","11265"
"2,7,11-Cembratrien-4,6-diol","C20H34O2","C09072","11264"
"2-Amino-3-oxo-4-phosphonooxybutyrate","C4H8NO7P","C07335","9542"
"Piroxicam","C15H13N3O4S","C01608","4761"
"(S)-20-Hydroxypregn-4-en-3-one","C21H32O2","C03965","6686"
"Osladin","C45H74O17","C08905","11097"
"Isochondrodendrine","C36H38N2O6","C09543","11734"
"Abyssinone VI","C25H28O4","C08573","10766"
"Oxacillin","C19H19N3O5S","C07334","9541"
"Affinisine","C20H24N2O","C09022","11214"
"Precocene 1","C12H14O2","C09017","11209"
"Vobtusine","C43H50N4O6","C09254","11445"
"Methylripariochromene A","C14H18O4","C09015","11207"
"5-O-Methylalloptaeroxylin","C16H16O4","C09014","11206"
"Affinine","C20H24N2O2","C09021","11213"
"Adifoline","C22H20N2O7","C09020","11212"
"1-Acetylaspidoalbidine","C21H26N2O2","C09019","11211"
"Vobasine","C21H24N2O3","C09253","11444"
"Geranyl acetate","C12H20O2","C09861","12047"
"Vernoflexin","C20H24O4","C09578","11769"
"Vernoflexuoside","C21H28O8","C09579","11770"
"Vernodalin","C19H20O7","C09576","11767"
"Vernodalol","C20H24O8","C09577","11768"
"Diosphenol","C10H16O2","C09854","12041"
"Vernolide","C19H22O7","C09583","11774"
"Macoline","C37H41N2O6+","C09580","11771"
"Phenylthioacetohydroximate","C8H9NOS","C03719","6485"
"Fenchone","C10H16O","C09859","12045"
"Cernuine","C16H26N2O","C09860","12046"
"Vernomenin","C15H16O5","C09584","11775"
"Vernomygdin","C19H24O7","C09585","11776"
"alpha-D-Glutamyl phosphate","C5H10NO7P","C03734","6497"
"Voacamine","C43H52N4O5","C09252","11443"
"Furcatin","C20H28O10","C10458","12641"
"Homoferreirin","C17H16O6","C10457","12640"
"Forsythiaside","C29H36O15","C10456","12639"
"Quercetin 3-O-glucoside","C21H20O12","C05623","7940"
"5-Hydroxyferulate","C10H10O5","C05619","7937"
"Quinalphos","C12H15N2O3PS","C11030","13213"
"Gingerenone A","C21H24O5","C10460","12643"
"[6]-Gingerdione","C17H24O4","C10459","12642"
"S-53482","C19H15FN2O4","C11035","13218"
"MK-129","C21H18ClNO3","C11034","13217"
"12a-Hydroxyrotenone","C23H22O7","C10464","12647"
"Grandidentatin","C21H28O9","C10463","12646"
"Phenylpropanoate","C9H10O2","C05629","7943"
"Thienodolin","C11H7ClN2OS","C09245","11436"
"Tubulosine","C29H37N3O3","C09248","11439"
"Tamibarotene","C22H25NO3","C12864","583253"
"Trichotomine","C30H20N4O6","C09247","11438"
"GDP-4-dehydro-6-deoxy-L-mannose","C16H23N5O15P2","C05344","7722"
"Oseltamivir","C16H28N2O4","C08092","10292"
"3-Methylbutanal","C5H10O","C07329","9537"
"Matairesinol","C20H22O6","C10682","12865"
"Furofoline I","C16H11NO3","C10681","12864"
"2',6'-Dihydroxy-4'-methoxyacetophenone","C9H10O4","C10680","12863"
"Flindersine","C14H13NO2","C10679","12862"
"Flindersiamine","C14H11NO5","C10678","12861"
"Febrifugine","C16H19N3O3","C10677","12860"
"gamma-Fagarine","C13H11NO3","C10676","12859"
"3',4'-Dihydroxyacetophenone","C8H8O3","C10675","12858"
"3-Methylbutanol","C5H12O","C07328","9536"
"2',6'-Dimethoxy-4'-hydroxyacetophenone","C10H12O4","C10684","12867"
"Galipine","C20H21NO3","C10683","12866"
"N-Carbamoyl-L-aspartate","C5H8N2O5","C00438","3727"
"4-Chlorophenol","C6H5ClO","C02124","5203"
"Pyridine-3-aldehyde","C6H5NO","C07327","9535"
"Baicalein","C15H10O5","C10023","12209"
"Baicalein 5,6,7-trimethyl ether","C18H16O5","C10024","12210"
"Axillarin","C17H14O8","C10021","12207"
"2-Phenethylsulfanyl-5,6,7,8-tetrahydro-benzo[4,5]thieno[2,3-d]pyrimidin-4-ylamine","C18H19N3S2","C11567","13732"
"(5,12,13-Triaza-indeno[1,2-b]anthracen-13-yl)-acetic acid ethylester","C22H17N3O2","C11568","13733"
"8-Allyl-2-phenyl-8H-1,3a,8-triaza-cyclopenta[a]indene","C18H15N3","C11565","13730"
"3-(4-Chloro-benzyl)-5-(2-methoxy-phenyl)-[1,2,4]oxadiazole","C16H13ClN2O2","C11566","13731"
"1-Benzyl-7,8-dimethoxy-3-phenyl-3H-pyrazolo[3,4-c]isoquinoline","C25H21N3O2","C11563","13728"
"N-(3-Benzooxazol-2-yl-4-hydroxy-phenyl)-2-p-tolyloxyacetamide","C22H18N2O4","C11564","13729"
"Calystegin A3","C7H13NO3","C10850","13033"
"N-[2-(4-Chloro-phenyl)-acetyl]-N'-(4,7-dimethyl-quinazolin-2-yl)-guanidine","C19H18ClN5O","C11562","13727"
"Chlorflavonin","C18H15ClO7","C10027","12213"
"2,2'-(1-phenyl-1H-1,2,4-triazole-3,5-diyl)bis-phenol","C20H15N3O2","C11569","13734"
"2-(2-Chloro-phenyl)-5-(5-methylthiophen-2-yl)-[1,3,4]oxadiazole","C13H9ClN2OS","C11570","13735"
"Baicalin","C21H18O11","C10025","12211"
"Carlinoside","C26H28O15","C10026","12212"
"4-Sulfolactone","C6H6O7S","C06676","8901"
"Toluene-4-sulfonate","C7H8O3S","C06677","8902"
"L-4-Hydroxyglutamate semialdehyde","C5H9NO4","C05938","8224"
"Linatine","C10H17N3O5","C05939","8225"
"10-Formyltetrahydrofolyl L-glutamate","C25H30N8O10","C05928","8216"
"N2-Succinyl-L-glutamate","C9H13NO7","C05931","8219"
"Neopterin","C9H11N5O4","C05926","8214"
"7,8-Dihydromethanopterin","C30H43N6O16P","C05927","8215"
"2-Oxoarginine","C6H11N3O3","C05935","8222"
"N4-Acetylaminobutanal","C6H11NO2","C05936","8223"
"4-Sulfocatechol","C6H6O5S","C06674","8899"
"N-(omega)-Hydroxyarginine","C6H14N4O3","C05933","8221"
"ProPAM","C7H10N2O","C11765","13929"
"Rivastigmine","C14H22N2O2","C11766","13930"
"Sulfasalazine","C18H14N4O5S","C07316","9524"
"Sulfamethoxazole","C10H11N3O3S","C07315","9523"
"Chlorsulfuron","C12H12ClN5O4S","C05071","7521"
"Previtamin D(3)","C27H44O","C07711","9913"
"Telmisartan","C33H30N4O2","C07710","9912"
"Streptozocin (TN ZANOSAR)","C8H15N3O7","C07313","9521"
"Stavudine","C10H12N2O4","C07312","9520"
"Octreotide","C49H66N10O10S2","C07306","9514"
"Deacetylisoipecoside","C25H33NO11","C07304","9512"
"Sotalol","C12H20N2O3S","C07309","9517"
"Deacetylipecoside","C25H33NO11","C07307","9515"
"(9R,10R)-Dihydroxyoctadecanoic acid","C18H36O4","C08314","10512"
"Muscimol","C4H6N2O2","C08311","10509"
"5-Aminolevulinate","C5H9NO3","C00430","3719"
"Enmein","C20H26O6","C09090","11282"
"Hemin","C34H30ClFeN4O4.2H","","170195"
"Prostaglandin H2","C20H32O5","C00427","3717"
"UDP-AAGM-DIAMINOHEPTANEDIOATE","C35H55N7O26P2","","3252"
"Patent blue","C27H31N2NaO6S2","C13725","586314"
"Adenophostin B","C18H28N5O19P3","C13722","586311"
"Cyanotriphenylborate","C19H15BNNa","C13721","586310"
"alpha-EMTBL","C7H12OS","C13720","586309"
"Nocodazole","C14H11N3O3S","C13719","586308"
"Dieldrin","C12H8Cl6O","C13718","586307"
"beta-EMGBL","C7H12O2","C13717","586306"
"Ro 19-4603","C15H17N3O3S","C13716","586305"
"4-Aminopyridine","C5H6N2","C13728","586317"
"Adenophostin A","C16H26N5O18P3","C13727","586316"
"Phenylpropionylglycine","C11H13NO3","",""
"Methyl(2-furoylamino)acetic acid","C8H9NO4","","298960"
"Monomethyl glutaric acid","C6H10O4","","216150"
"Methylhippuric acid","C10H11NO3","","157837"
"Umanopterin","C9H11N5O4","",""
"2-Octenoic acid","C8H14O2","","21288"
"Tenoxicam","C13H11N3O4S2","C13234","585978"
"Diflucortolone valerate","C27H36F2O5","C13231","585975"
"Mepitiostane","C25H40O2S","C13062","585126"
"Acetylsulfamethoxazole","C12H13N3O4S","C13061","585125"
"Propyliodone","C10H11I2NO3","C13222","585966"
"Niceritrol","C29H24N4O8","C13221","585965"
"Besigomsin","C23H28O7","C13219","585963"
"Fenipentol","C11H16O","C13218","585962"
"Broxuridine","C9H11BrN2O5","C13230","585974"
"Ioxaglic acid","C24H21I6N5O8","C13228","585972"
"Ranimustine","C10H18ClN3O7","C13227","585971"
"Haloxazolam","C17H14BrFN2O2","C13225","585969"
"Hordatine A","C28H38N8O4","C08307","10505"
"beta-Eucaine","C15H21NO2","C14167","7846979"
"3-(Dimethylamino)propyl benzoate","C12H17NO2","C14168","7846980"
"Phenyl salicylate","C13H10O3","C14163","7846975"
"Acetrizoic acid","C9H6I3NO3","C14164","7846976"
"Metrizoic acid","C12H11I3N2O4","C14165","7846977"
"alpha-Eucaine","C19H27NO4","C14166","7846978"
"Stylisterol C","C28H46O3","C14159","7846971"
"Hatomasterol","C28H46O3","C14160","7846972"
"Gibberellin A37","C20H26O5","C14161","7846973"
"Gibberellin A15","C20H26O4","C14162","7846974"
"Nopaline","C11H20N4O6","C08508","10701"
"6-O-Methyleuparin","C14H14O3","C08762","10955"
"Ruscopine","C16H26N4O2","C08510","10703"
"Tenuazonic acid","C10H15NO3","C08511","10704"
"Macrozamin","C13H24N2O11","C08504","10697"
"Purpureacin-1","C37H66O8","C08505","10698"
"Castelanone","C25H34O9","C08755","10948"
"Miserotoxin","C9H17NO8","C08507","10700"
"Hordatine B","C29H40N8O5","C08308","10506"
"Ranunculin","C11H16O8","C08512","10705"
"Acetylcaranine","C18H19NO4","C08513","10706"
"Glaucarubinone","C25H34O10","C08763","10956"
"Glaucarubolone","C20H26O8","C08764","10957"
"3-Aminopropanal","C3H7NO","C02229","5293"
"UDPglucose","C15H24N2O17P2","C00029","3331"
"D-Glucose","C6H12O6","C00031","3333"
"(+)-Camphor","C10H16O","C00808","4066"
"(-)-Camphor","C10H16O","C00809","4067"
"Pentanoate","C5H10O2","C00803","4061"
"Propynoate","C3H2O2","C00804","4062"
"Salicylate","C7H6O3","C00805","4063"
"Tryptophan","C11H12N2O2","C00806","4064"
"L-Glutamate","C5H9NO4","C00025","3327"
"2-Oxoglutarate","C5H6O5","C00026","3328"
"L-Gulonate","C6H12O7","C00800","4058"
"Oxalureate","C3H4N2O4","C00802","4060"
"Bromocriptine","C32H40BrN5O5","C06856","9074"
"2-Methylcitrate","C7H10O7","C02225","5290"
"3-Amino-4,7-dihydroxy-8-chlorocoumarin","C9H6ClNO4","C12469","582859"
"trans-Tetradec-2-enoyl-CoA","C35H60N7O17P3S","C05273","7660"
"Decanoyl-CoA","C31H54N7O17P3S","C05274","7661"
"trans-Hex-2-enoyl-CoA","C27H44N7O17P3S","C05271","7658"
"trans-Hexadec-2-enoyl-CoA","C37H64N7O17P3S","C05272","7659"
"trans,cis-Lauro-2,6-dienoyl-CoA","C33H54N7O17P3S","C05279","7666"
"cis,cis-3,6-Dodecadienoyl-CoA","C33H54N7O17P3S","C05280","7667"
"trans-Dec-2-enoyl-CoA","C31H52N7O17P3S","C05275","7662"
"trans-Oct-2-enoyl-CoA","C29H48N7O17P3S","C05276","7663"
"(5-L-Glutamyl)-L-glutamate","C6H10O4","C05282","7669"
"(5-L-Glutamyl)-L-glutamine","C7H12O3","C05283","7670"
"Chlorobiocic acid","C21H18ClNO6","C12471","582861"
"3,3',5'-Triiodothyronine","C15H12I3NO4","C07639","9841"
"Celosianin II","C40H42N2O22","C08542","10735"
"Dopaxanthin","C18H18N2O8","C08543","10736"
"(+)-Adlumine","C21H21NO6","C09324","11515"
"Aknadicine","C19H23NO5","C09325","11516"
"3-Hydroxy-L-kynurenine","C10H12N2O4","C03227","6099"
"3-Demethylubiquinone-9","C52H78O4","C03226","6098"
"Afzelechin","C15H14O5","C09320","11511"
"3,5-Dibromo-L-tyrosine","C9H9Br2NO3","C03224","6096"
"Dimercaprol","C3H8OS2","C02924","5847"
"2,3-Dihydroxytoluene","C7H8O2","C02923","5846"
"2-cis,6-trans-Farnesol","C15H26O","C03220","6093"
"2-Methylpropanal oxime","C4H9NO","C03219","6092"
"Abyssinone I","C20H18O4","C09318","11509"
"2-Dehydro-D-xylonate","C5H8O6","C02928","5850"
"3-(Phosphoacetylamido)-L-alanine","C5H11N2O7P","C04111","6801"
"3-Methyl-cis,cis-hexadienedioate","C7H8O4","C04112","6802"
"Psorospermin","C19H16O6","C10090","12276"
"Norswertianolin","C19H18O11","C10089","12275"
"5,8,13,13a-Tetrahydrocolumbamine","C20H23NO4","C04118","6807"
"CMP-3-deoxy-D-manno-octulosonate","C17H26N3O15P","C04121","6808"
"D-1-Aminopropan-2-ol O-phosphate","C3H10NO4P","C04122","6809"
"Indole-3-acetyl-beta-1-D-glucose","C16H19NO7","C04124","6810"
"Isorhamnetin","C16H12O7","C10084","12270"
"2-O-Methylswertianin","C15H12O6","C10083","12269"
"Mesuaxanthone B","C13H8O5","C10082","12268"
"Mesuaxanthone A","C14H10O5","C10081","12267"
"Norswertianin","C13H8O6","C10088","12274"
"Norlichexanthone","C14H10O5","C10087","12273"
"Norathyriol","C13H8O6","C10086","12272"
"Morellin","C33H36O7","C10085","12271"
"Alachlor","C14H20ClNO2","C10928","13111"
"m-Methylbenzoate","C8H8O2","C07211","9420"
"Hexazinone","C12H20N4O2","C10926","13109"
"Irgarol 1051","C11H19N5S","C10927","13110"
"Carpropamid","C15H18Cl3NO","C10932","13115"
"Amidosulfuron","C9H15N5O7S2","C10933","13116"
"Metamitron","C10H10N4O","C10930","13113"
"Butachlor","C17H26ClNO2","C10931","13114"
"2,6-Dichlorobenzamide","C7H5Cl2NO","C10934","13117"
"N,N-Diethyl-m-toluamide","C12H17NO","C10935","13118"
"(13Z)-Docosenoic acid","C22H42O2","C08316","10514"
"D-Tagatose 1,6-bisphosphate","C6H14O12P2","C03785","6535"
"L-Kynurenine","C10H12N2O3","C00328","3622"
"(5Z,13E)-6,9alpha-Epoxy-11alpha-hydroxy-15-oxoprosta-5,13-dienoate","C20H30O5","C04835","7396"
"N6-(1,2-Dicarboxyethyl)-AMP","C14H18N5O11P","C03794","6543"
"1-Methylimidazole-4-acetate","C6H8N2O2","C05129","7549"
"Oleandomycin 2'-O-phosphate","C35H62NO15P","C03796","6545"
"Iridotrial glucoside","C16H24O8","C11653","13818"
"N-Dimethyl-2-aminoethylphosphonate","C4H12NO3P","C05680","7987"
"8-Epiiridotrial glucoside","C16H24O8","C11652","13817"
"8-Epiiridodial","C10H16O2","C11651","13816"
"Prostaglandin C2","C20H30O4","C05955","8239"
"8-Epideoxyloganin tetraacetate","C25H34O13","C11650","13815"
"Benzenebutanoic acid","C10H12O2","","303746"
"Iridodial glucoside tetraacetate","C24H34O11","C11657","13822"
"8-Epiiridodial glucoside","C16H26O7","C11656","13821"
"Kanamycin sulfate","C18H38N4O15S","C08046","10246"
"Netilmicin sulfate","C42H92N10O34S5","C08047","10247"
"Nitrofurazone","C6H6N4O4","C08042","10242"
"Amikacin sulfate","C22H47N5O21S2","C08045","10245"
"Chlorhexidine gluconate","C34H54Cl2N10O14","C08038","10238"
"Hexachlorophene","C13H6Cl6O2","C08039","10239"
"Dalfopristin","C34H50N4O9S","C08033","10233"
"beta-Aminopropionitrile","C3H6N2","C05670","7978"
"Tarennoside","C16H22O9","C11654","13819"
"beta-Aminopropion aldehyde","C3H7NO","C05665","7975"
"Spectinomycin hydrochloride","C14H36Cl2N2O12","C08049","10249"
"Sulfamethizole","C9H10N4O2S2","C08050","10250"
"3-Hydroxypropionyl-CoA","C24H40N7O18P3S","C05668","7976"
"muco-Inositol","C6H12O6","C06152","8408"
"6-(3'-Triphosphoryl-1'-methylglyceryl)-7-methyl-7,8-dihydrobiopterin","C11H20N5O13P3","C06149","8405"
"2,5-Diamino-6-(5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl)-amino-4-oxopyrimidine","C9H18N5O14P3","C06148","8404"
"3-Butyn-1-ol","C4H6O","C06146","8402"
"3-Butyn-1-al","C4H4O","C06145","8401"
"3-Butynoate","C4H4O2","C06144","8400"
"1-Butanol","C4H10O","C06142","8398"
"(S)-3-Hydroxybutanoyl-CoA","C25H42N7O18P3S","C01144","4375"
"1D-myo-Inositol 1,4-bisphosphate","C6H14O12P2","C01220","4442"
"L-myo-Inositol 5-phosphate","C6H13O9P","C06155","8411"
"scyllo-Inositol","C6H12O6","C06153","8409"
"Dihydrostreptomycin 6-phosphate","C21H42N7O15P","C01221","4443"
"Mucronulatol","C17H18O5","C10507","12690"
"1-Amino-1-deoxy-scyllo-inositol","C6H13NO5","C01214","4436"
"2-(Acetamidomethylene)succinate","C7H9NO5","C01215","4437"
"2-Dehydro-3-deoxy-D-galactonate","C6H10O6","C01216","4438"
"2-Hydroxycyclohexan-1-one","C6H10O2","C01147","4377"
"D-Xylulose","C5H10O5","C00310","3604"
"D-Ribulose","C5H10O5","C00309","3603"
"L-Xylulose","C5H10O5","C00312","3606"
"Isocitrate","C6H8O7","C00311","3605"
"Bradykinin","C50H73N15O11","C00306","3600"
"Kanamycin","C18H36N4O11","C00304","3598"
"Canavanine","C5H12N4O3","C00308","3602"
"CDPcholine","C14H26N4O11P2","C00307","3601"
"Pyridoxine","C8H11NO3","C00314","3608"
"Oxalyl-CoA","C23H36N7O19P3S","C00313","3607"
"(+/-)-Bocconarborine B","C44H36N2O9","C12197","14343"
"(+/-)-Bocconarborine A","C44H36N2O9","C12196","14342"
"3-Methoxy-8,9-methylenedioxy-3,4-dihydrophenanthridine","C15H13NO3","C12199","14345"
"6-(2-Hydroxyethyl)-5,6-dihydrosanguinarine","C22H19NO5","C12198","14344"
"(+/-)-6-Acetonyldihydrosanguinarine","C23H19NO5","C12201","14347"
"(+/-)-6-Acetonyldihydrochelerythrine","C24H23NO5","C12200","14346"
"5-Hydroxyferuloyl-CoA","C31H44N7O20P3S","C12203","14349"
"Platenolide A","C20H32O6","C12202","14348"
"5-Hydroxyconiferyl alcohol","C10H12O4","C12205","14351"
"5-Hydroxyconiferaldehyde","C10H10O4","C12204","14350"
"delta-3,4,5,6-Tetrachlorocyclohexene","C6H6Cl4","C06989","9202"
"1,2-Dihydrovomilenine","C21H24N2O3","C11808","13972"
"Vinorine","C21H22N2O2","C11807","13971"
"Encainide","C22H28N2O2","C06978","9192"
"Enoxacin","C15H17FN4O3","C06979","9193"
"Esmolol","C16H25NO4","C06980","9194"
"Estazolam","C16H11ClN4","C06981","9195"
"Ethacrynic acid","C13H12Cl2O4","C06983","9197"
"Norajmaline","C19H24N2O2","C11810","13974"
"Spirodilactone","C11H8O4","C06986","9200"
"beta-1,2,3,4,5,6-Hexachlorocyclohexane","C6H6Cl6","C06988","9201"
"17-O-Acetylnorajmaline","C21H26N2O3","C11809","13973"
"Lochnerinine","C22H26N2O4","C11812","13976"
"1-Hydroxy-2-methyl-2-butenyl 4-diphosphate","C5H12O8P2","C11811","13975"
"AMPA","CH6NO3P","C11033","13216"
"Demethylisoalangiside","C24H29NO10","C11814","13978"
"Demethylalangiside","C24H29NO10","C11813","13977"
"Salicin","C13H18O7","C01451","4628"
"Queuine","C12H15N5O3","C01449","4626"
"Questin","C16H12O5","C01448","4625"
"Oxamate","C2H3NO3","C01444","4622"
"Toluene","C7H8","C01455","4632"
"Toluate","C8H8O2","C01454","4631"
"Tacrine","C13H14N2","C01453","4630"
"(9Z)-Octadecenoic acid","C18H34O2","C00712","3978"
"Serine","C3H7NO3","C00716","3982"
"Pterin","C6H5N5O","C00715","3981"
"Tylosin","C46H77NO17","C01457","4634"
"Tropate","C9H10O3","C01456","4633"
"6-Dimethylaminopurine","C7H9N5","","326310"
"7a-Hydroxy-3-oxo-4-cholenoic acid","C24H36O4","","770853"
"Nutriacholic acid","C24H38O4","","380848"
"4-Octenedioic acid","C8H12O4","","661214"
"7-Hydroxy-3-oxocholanoic acid","C24H38O4","",""
"3-Methylcrotonylglycine","C7H11NO3","","747005"
"5a-Androstane-3a,17a-diol","C19H32O2","",""
"4Z,15E-Bilirubin IXa","C33H36N4O6","",""
"3,4-Dihydroxyphenylglycol","C8H10O4","","330203"
"3-Oxo-4,6-choladienoic acid","C24H34O3","",""
"Atrolactic acid","C9H10O3","","258211"
"N-Methylhydantoin","C4H6N2O2","C02565","5563"
"Punicic acid","C18H30O2","C08364","10560"
"N-Acetylimidazole","C5H6N2O","C02560","5560"
"N-Feruloylglycine","C12H13NO5","C02564","5562"
"2-Methoxyestradiol-17beta 3-sulfate","C19H26O6S","C08359","10556"
"2-Methoxyestrone 3-sulfate","C19H24O6S","C08358","10555"
"(6Z)-Octadecenoic acid","C18H34O2","C08363","10559"
"(9Z)-Hexadecenoic acid","C16H30O2","C08362","10558"
"3-(3,4-Dihydroxypyridin-1-yl)-L-alanine","C8H11N2O4+","C04446","7075"
"(9Z)-(12R,13S)-12,13-Epoxyoctadecenoic acid","C18H32O3","C08368","10564"
"Neryl diphosphate","C10H20O7P2","C02569","5566"
"O-Acetylcarnitine","C9H18NO4+","C02571","5567"
"C25-Allenic-apo-aldehyde","C25H34O3","C14044","854282"
"C25-Epoxy-apo-aldehyde","C25H34O3","C14045","854283"
"Uracil 5-carboxylate","C5H4N2O4","C03030","5935"
"9,10-Dihydroergocornine methanesulfonate","C32H45N5O8S","C14053","854291"
"Dihydro-beta-ergocryptine mesylate","C33H47N5O8S","C14054","854292"
"Leucomycin A1","C40H67NO14","C14056","854294"
"Leucomycin A4","C41H67NO15","C14057","854295"
"p-Anisaldehyde","C8H8O2","C10761","12944"
"Cularicine","C18H17NO4","C09398","11589"
"3-Hydroxy-vitamin K","C31H48O3","C02785","5736"
"Leucomycin A5","C39H65NO14","C14058","854296"
"Drimenin","C15H22O2","C09399","11590"
"2-Deoxy-D-galactose","C6H12O5","C02781","5732"
"2-Deoxy-D-gluconate","C6H12O6","C02782","5733"
"2-Deoxy-L-arabinose","C5H10O4","C02783","5734"
"Leucomycin A6","C40H65NO15","C14059","854297"
"2,5-Dioxopiperazine","C4H6N2O2","C02777","5728"
"Dihydrogriesenin","C15H18O4","C09396","11587"
"2-Dehydro-D-glucose","C6H10O6","C02779","5730"
"2-Dehydro-L-idonate","C6H8O7","C02780","5731"
"Dihydromikanolide","C15H16O6","C09397","11588"
"Isoproterenol","C11H17NO3","C07056","9268"
"5-Phosphonooxy-L-lysine","C6H15N2O6P","C03366","6203"
"6-Prenylnaringenin","C20H20O5","C09832","12020"
"Elephantopin","C19H20O7","C09403","11594"
"Cularidine","C19H21NO4","C09400","11591"
"Fisetinidol","C15H14O5","C09735","11923"
"Eleganin","C22H26O9","C09401","11592"
"Isoniazid","C6H7N3O","C07054","9266"
"alpha-Sinensal","C15H22O","C09729","11917"
"1-Phenylhepta-1,3,5-triyne","C13H8","C08456","10649"
"(S)-3-Hydroxyisobutyrate","C4H8O3","C06001","8275"
"Poncirin","C28H34O14","C09830","12018"
"(S)-Methylmalonate semialdehyde","C4H6O3","C06002","8276"
"Lamivudine","C8H11N3O3S","C07065","9277"
"Sanggenon D","C40H36O12","C09835","12023"
"Ascaridole","C10H16O2","C09836","12024"
"Sakuranetin","C16H14O5","C09833","12021"
"Sanggenon C","C40H36O12","C09834","12022"
"5'-Prenylhomoeriodictyol","C21H22O6","C09831","12019"
"16alpha-Hydroxyandrost-4-ene-3,17-dione","C19H26O3","C05140","7559"
"Piperaduncin B","C29H30O8","C09829","12017"
"Anisessine","C20H19N3O3","C10637","12820"
"Mycosinol","C13H10O3","C08455","10648"
"Justicidin B","C21H16O6","C10636","12819"
"(1S,2R,4S)-(-)-Bornyl acetate","C12H20O2","C09837","12025"
"Debromoaplysiatoxin","C32H48O10","C05148","7566"
"Aniflorine","C20H21N3O3","C10635","12818"
"Arborine","C16H14N2O","C10642","12825"
"7-Hydroxy-6-methyl-8-ribityl lumazine","C12H16N4O7","C05995","8269"
"Kadsurin A","C21H24O6","C10640","12823"
"Anisotine","C20H19N3O3","C10639","12822"
"Ethyl 3-oxobutanoate","C6H10O3","C03500","6312"
"Ethyl (R)-3-hydroxybutanoate","C6H12O3","C03499","6311"
"Deoxy-ribose 1-phosphate","C5H11O7P","C03496","6308"
"Deoxy-5-methylcytidylate","C10H16N3O7P","C03495","6307"
"D-Erythritol 4-phosphate","C4H11O7P","C03494","6306"
"D-4-Hydroxyphenylglycine","C8H9NO3","C03493","6305"
"D-4'-Phosphopantothenate","C9H18NO8P","C03492","6304"
"Chenodeoxycholoyltaurine","C26H45NO6S","C03487","6299"
"CDP-N-methylethanolamine","C12H22N4O11P2","C03486","6298"
"Aromatic primary alcohol","C7H8O","C03485","6297"
"Zalcitabine","C9H13N3O3","C07207","9416"
"Validamycin A","C20H35NO13","C12112","14259"
"Ochratoxin A","C20H18ClNO6","C09955","12141"
"Convallamaroside","C57H94O27","C08892","11085"
"3'-Demethoxypiplartine","C16H19NO4","C10444","12627"
"Curcumin","C21H20O6","C10443","12626"
"4-Hydroxyphenylacetylglycine","C10H11NO4","C05596","7920"
"Phenylacetylglutamine","C13H16N2O4","C05597","7921"
"Convallamarogenin","C27H42O4","C08891","11084"
"5-O-Caffeoylshikimic acid","C16H16O8","C10434","12619"
"1-Caffeoyl-beta-D-glucose","C15H18O9","C10433","12618"
"Centrolobine","C20H24O3","C10436","12621"
"Carpacin","C11H12O3","C10435","12620"
"Cinnamic acid","C9H8O2","C10438","12623"
"Chicoric acid","C22H18O12","C10437","12622"
"4-p-Coumaroylquinic acid","C16H18O8","C10441","12625"
"4'-Cinnamoylmussatioside","C34H44O16","C10439","12624"
"NAC","C17H18N2O2","C11486","13656"
"EPA","C10H13NO","C11487","13657"
"2-Methyl-6-oxohepta-2,4-dienal","C8H12O2","C11480","13650"
"MEGA","C19H23N3O2","C11483","13653"
"GA","C17H19N3O2","C11484","13654"
"LY201116","C15H16N2O","C11485","13655"
"D-glycero-D-manno-Heptose 1,7-bisphosphate","C7H16O13P2","C11472","13642"
"Evisect","C5H11NS3","C11473","13643"
"Nereistoxin","C5H11NS2","C11474","13644"
"L-Arabinose","C5H10O5","C11476","13646"
"1,2-Bis(4-hydroxy-3-methoxyphenyl)ethylene","C16H16O4","C04547","7153"
"(R)-3-((R)-3-Hydroxybutanoyloxy)butanoate","C8H14O5","C04546","7152"
"Magnesium protoporphyrin monomethyl ester","C35H34MgN4O4","C04536","7143"
"7-Methyl-2-hydroxy-6-oxoocta-2,4-dienoate","C9H12O4","C04535","7142"
"6-Phospho-beta-D-glucosyl-(1,4)-D-glucose","C12H23O14P","C04534","7141"
"Paeoniflorin","C23H28O11","C09959","12145"
"gamma-L-Glutamyl-L-cysteinyl-beta-alanine","C11H19N3O6S","C04544","7150"
"S-Butyl-DL-homocysteine-[S,R]-sulfoximine","C8H18N2O3S","C04543","7149"
"N5-Dinitrophenyl-L-ornithine methyl ester","C18H20N4O6","C04541","7147"
"Sebacic acid","C10H18O4","C08277","10475"
"WIN56291","C16H16Cl2N2O3","C06499","8730"
"5'-Guanosyl-methylene-triphosphate","C11H18N5O13P3","C06500","8731"
"WIN I(S)","C21H28N2O3","C06497","8728"
"Compound I(R)","C21H28N2O3","C06498","8729"
"alpha-Kosin","C25H32O8","C10704","12887"
"Leiokinine A","C14H17NO2","C10703","12886"
"Phosphotyrosine","C9H12NO6P","C06501","8732"
"Hydrogenobyrinate a,c diamide","C45H62N6O12","C06503","8734"
"4'-Hydroxyacetophenone","C8H8O2","C10700","12883"
"Japonine","C18H17NO3","C10699","12882"
"Adenosyl cobyrinate a,c diamide","C55H73CoN11O15+","C06506","8737"
"Adenosyl cobyrinate hexaamide","C55H77CoN15O11+","C06507","8738"
"Hydroquinidine","C20H26N2O2","C10696","12879"
"Humulone","C21H30O5","C10695","12878"
"Isofebrifugine","C16H19N3O3","C10698","12881"
"Vancomycin","C66H75Cl2N9O24","C06689","8914"
"2-Hydroxy-6-oxo-6-(2-hydroxyphenyl)-hexa-2,4-dienoate","C12H10O5","C07731","9933"
"Dibenzofuran","C12H8O","C07729","9931"
"2,2',3-Trihydroxydiphenylether","C12H10O4","C07733","9935"
"Dibenzo-p-dioxin","C12H8O2","C07732","9934"
"Etidronic acid","C2H8O7P2","C07736","9938"
"2-Hydroxy-6-oxo-6-(2-hydroxyphenoxy)-hexa-2,4-dienoate","C12H10O6","C07734","9936"
"Moricizine","C22H25N3O4S","C07743","9945"
"Disopyramide phosphate","C21H32N3O5P","C07740","9942"
"Dofetilide","C19H27N3O5S2","C07751","9953"
"Tolterodine","C22H31NO","C07750","9952"
"Bixin","C25H30O4","C08582","10775"
"Zafirlukast","C31H33N3O6S","C07206","9415"
"Car-3-ene","C10H16","C09839","12026"
"2-Hydroxymalonate","C3H4O5","C02500","5512"
"demethylmenaquinone","C19H20O2","",""
"Canthaxanthin","C40H52O2","C08583","10776"
"2-Hydroxybiphenyl","C12H10O","C02499","5511"
"Convallagenin A","C27H44O5","C08890","11083"
"Anthemis glycoside B","C34H41NO17","C08327","10525"
"3',5'-Cyclic dGMP","C10H12N5O6P","C02507","5519"
"Ethidium bromide","C21H20BrN3","C11161","13343"
"Tetramethylthioperoxydicarbonic diamide","C6H12N2S4","C11160","13342"
"n-Propyl gallate","C10H12O5","C11155","13337"
"Trimetrexate","C19H23N5O3","C11154","13336"
"VM-26","C32H32O13S","C11153","13335"
"Tetraphenylphosphonium","C24H20P+","C11152","13334"
"Tiron","C6H4Na2O8S2","C11159","13341"
"Topotecan","C23H23N3O5","C11158","13340"
"Flupenthixol","C23H25F3N2OS","C11157","13339"
"Triadimefon","C14H16ClN3O2","C11156","13338"
"Cardiospermin","C11H17NO7","C08328","10526"
"21-Hydroxysteroid","C21H30O4","C02506","5518"
"Homocystine","C8H16N2O4S2","C01817","4941"
"NADPH","C21H30N7O17P3","C00005","3307"
"Vernadigin","C30H44O10","C08884","11077"
"Desmosterol","C27H44O","C01802","4928"
"Fleroxacin","C17H18F3N3O3","C13179","585243"
"Deidaclin","C12H17NO6","C08329","10527"
"Betadex","C42H70O35","C13183","585247"
"Mofezolac","C19H17NO5","C13181","585245"
"Pentaerythritol tetranitrate","C5H8N4O12","C13186","585250"
"Iomeprol","C17H22I3N3O8","C13184","585248"
"m-Iodobenzylguanidine-123I","C8H10IN3","C13195","585939"
"Romurtide","C43H78N6O13","C13187","585251"
"Sorivudine","C11H13BrN2O6","C13201","585945"
"Anecortave acetate","C23H30O5","C13200","585944"
"Metyrapone","C14H14N2O","C07205","9414"
"p-Glucosyloxymandelonitrile","C14H17NO7","C08330","10528"
"2-Benzothiazolesulfonamide","C7H6N2O2S2","C14181","210062"
"m-Benzenedisulfonamide","C6H8N2O4S2","C14182","6041834"
"Sulfoacetate","C2H4O5S","C14179","7846991"
"S-(Hydroxymethyl)glutathione","C11H19N3O7S","C14180","7846992"
"Heptachlor","C10H5Cl7","C14185","7846995"
"Prometon","C10H19N5O","C14186","7846996"
"Compactin diol lactone","C18H26O4","C14183","7846993"
"Mirex","C10Cl12","C14184","7846994"
"1,1,1-Trichloro-2-(o-chlorophenyl)-2-(p-chlorophenyl)ethane","C14H9Cl5","C14187","7846997"
"3-tert-Butylphenol","C10H14O","C14188","7846998"
"ADP","C10H15N5O10P2","C00008","3310"
"Rinderine","C15H25NO5","C10378","12564"
"Gynocardin","C12H17NO8","C08331","10529"
"4,5-Dihydroxy-2,3-pentanedione","C5H8O4","C11838","14000"
"Gomphrenin-V","C34H34N2O16","C08547","10740"
"ATP","C10H16N5O13P3","C00002","3304"
"L-Arogenate","C10H13NO5","C00826","4084"
"Lactoyl-CoA","C24H40N7O18P3S","C00827","4085"
"1-Hexadecanol","C16H34O","C00823","4081"
"Kanamycin B","C18H37N5O10","C00825","4083"
"Pantetheine","C11H22N2O4S","C00831","4089"
"Paromomycin","C23H45N5O14","C00832","4090"
"Naphthalene","C10H8","C00829","4087"
"Oxomalonate","C3H2O5","C00830","4088"
"Sepiapterin","C9H11N5O3","C00835","4093"
"Heterodendrin","C11H19NO6","C08332","10530"
"Glyoxal","C2H2O2","C14448","150965"
"Epichlorohydrin","C3H5ClO","C14449","150934"
"Tris(butoxyethyl)phosphate","C18H39O7P","C14446","149504"
"2-Methylpyridine","C6H7N","C14447","151089"
"2-Aminoanthraquinone","C14H9NO2","C14444","151482"
"Tris(2-chloroethyl)phosphate","C6H12Cl3O4P","C14445","151432"
"Fenitrothion","C9H12NO5PS","C14442","173229"
"3,3'-Dimethylbenzidine","C14H16N2","C14443","151563"
"Formamidopyrimidine nucleoside triphosphate","C10H18N5O15P3","C05922","8210"
"4-Chloroaniline","C6H6ClN","C14450","150908"
"4-Chlorotoluene","C7H7Cl","C14451","150904"
"Theasinensin A","C44H34O22","C09972","12158"
"Linustatin","C16H27NO11","C08333","10531"
"3-Cyano-L-alanine","C4H6N2O2","C02512","5522"
"Stypandrol","C26H22O6","C09971","12157"
"Lotaustralin","C11H19NO6","C08334","10532"
"3-(ADP)-glycerate","C13H19N5O13P2","C02509","5521"
"Eriobofuran","C14H12O4","C08743","10936"
"6-Hydroxytremetone","C13H14O3","C08744","10937"
"alpha-Cotonefuran","C15H14O6","C08739","10932"
"beta-Cotonefuran","C16H16O6","C08740","10933"
"Dehydrotremetone","C13H12O2","C08741","10934"
"2,8-Dihydroxy-3,4,7-trimethoxydibenzofuran","C15H14O6","C08742","10935"
"2,4,8-Trihydroxy-1-tetralone","C10H10O4","C09974","12160"
"2-Chloro-4,6-dihydroxy-1,3,5-triazine","C3H2ClN3O2","C08736","10929"
"Melamine","C3H6N6","C08737","10930"
"Albanol A","C34H26O8","C08738","10931"
"Paucin","C23H32O10","C09525","11716"
"Broussonin C","C20H24O3","C09524","11715"
"Orizabin","C19H26O7","C09521","11712"
"Onopordopicrin","C19H24O6","C09520","11711"
"Parthenin","C15H18O4","C09523","11714"
"Ovatifolin","C17H22O5","C09522","11713"
"Niveusin C","C20H26O7","C09517","11708"
"Multistatin","C20H22O6","C09516","11707"
"Oblongolide","C14H20O2","C09519","11710"
"Nobilin","C20H26O5","C09518","11709"
"6-Methoxymellein","C11H12O4","C02381","5423"
"Tremulacin","C27H28O11","C09973","12159"
"Biotin amide","C10H17N3O2S","C01893","5006"
"Acetylenedicarboxylate","C4H2O4","C03248","6117"
"Aminoacetone","C3H7NO","C01888","5001"
"Cetraxate benzyl ester","C24H29NO4","C03256","6122"
"(8Z,11Z,14Z)-Icosatrienoic acid","C20H34O2","C03242","6112"
"6-Hydroxyhexan-6-olide","C6H10O3","C03241","6111"
"ADPribose 2'-phosphate","C15H24N5O17P3","C03246","6116"
"Biotinyl-CoA","C31H50N9O18P3S2","C01894","5007"
"Uncinatone","C20H22O4","C09976","12162"
"(2-Naphthyl)methanol","C11H10O","C02909","5834"
"D-Asparagine","C4H8N2O3","C01905","5014"
"D-Arabitol","C5H12O5","C01904","5013"
"D-3-Amino-isobutanoate","C4H9NO2","C03265","6129"
"D-2-Hydroxyisocaproate","C6H12O3","C03264","6128"
"Digiferrugineol","C15H10O4","C10327","12513"
"Indicine","C15H25NO5","C10326","12512"
"1,4-Dihydroxy-2-methylanthraquinone","C15H10O4","C10329","12515"
"Integerrimine","C18H25NO5","C10328","12514"
"Myricetin","C15H10O8","C10107","12293"
"Cyperaquinone","C14H10O4","C10322","12508"
"Deoxylapachol","C15H14O2","C10325","12511"
"Myricitrin","C21H20O12","C10108","12294"
"Nevadensin","C18H16O7","C10111","12297"
"Neoschaftoside","C26H28O14","C10110","12296"
"2,6-Dimethoxybenzoquinone","C8H8O4","C10331","12517"
"Intermedine","C15H25NO5","C10330","12516"
"3-Hydroxy-3-methyl-2-oxobutanoic acid","C5H8O4","C04181","6858"
"4-Cinnamyl alcohol beta-glucoside","C15H20O6","C04183","6859"
"2',4',6'-Trihydroxy-3'-formyldihydrochalcone","C16H14O5","C09975","12161"
"Pyrazolate","C19H16Cl2N2O4S","C11123","13305"
"Uvaretin","C23H22O5","C09978","12164"
"DTP","C12H10Cl2N2O2","C11122","13304"
"D-2-Aminobutyrate","C4H9NO2","C02261","5323"
"Vismione D","C25H30O5","C09977","12163"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphonoethanolamine","C39H76NO7P","C13878","854123"
"Chrysin","C15H10O4","C10028","12214"
"1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine","C42H83NO8P+","C13875","854120"
"Gentiobiosyl-caldarchaeol","C98H192O16","C13874","854119"
"Nitrosobenzene","C6H5NO","C06876","9093"
"Protizinic acid","C17H17NO3S","C12585","582975"
"1,2-Dibromoethane","C2H4Br2","C11088","13270"
"Tricetin","C15H10O7","C10192","12378"
"Dipterocarpol","C30H50O2","C08622","10815"
"Ceftizoxime sodium","C13H12N5NaO5S2","C08118","10318"
"Ceftriaxone disodium salt hemiheptahydrate","C36H46N16Na4O21S6","C08119","10319"
"Dichloroacetylene","C2Cl2","C11089","13271"
"Cefpodoxime","C15H17N5O6S2","C08114","10314"
"Cefpodoxime proxetil","C21H27N5O9S2","C08115","10315"
"Ceftazidime pentahydrate","C22H32N6O12S2","C08116","10316"
"Ceftibuten","C15H14N4O6S2","C08117","10317"
"Cefdinir","C14H13N5O5S2","C08110","10310"
"Tephrosin","C23H22O7","C10535","12718"
"Cefoperazone sodium","C25H26N9NaO8S2","C08112","10312"
"Cefotaxime sodium","C16H16N5NaO7S2","C08113","10313"
"Hexachloro-1,3-butadiene","C4Cl6","C11091","13273"
"Azocyclotin","C20H35N3Sn","C11092","13274"
"Cyhexatin","C18H36OSn","C11093","13275"
"Anabasine","C10H14N2","C06180","8431"
"Carfentrazone-ethyl","C15H14Cl2F3N3O3","C11094","13276"
"Senecionine","C18H25NO5","C06176","8427"
"Oripavine","C18H19NO3","C06175","8426"
"1-Methylpyrrolinium","C5H10N+","C06178","8429"
"Clomazone","C12H14ClNO2","C11095","13277"
"Neopinone","C18H19NO3","C06172","8423"
"7,8-Didehydro-4,5-epoxy-3-methoxy-17-methoxy-(5_)-morphinan-6-one","C18H19NO3","C06171","8422"
"Codeine","C18H21NO3","C06174","8425"
"Thebaine","C19H21NO3","C06173","8424"
"Dehydromyodesmone","C15H18O2","C09658","11848"
"Dehydrojuvabione","C16H24O3","C09657","11847"
"Dehydrongaione","C15H20O3","C09660","11850"
"Thalmine","C37H40N2O6","C09659","11849"
"1,2-Dimethylnaphthalene","C12H12","C14329","154618"
"Thalsimine","C38H40N2O7","C09661","11851"
"beta-Eudesmol","C15H26O","C09664","11854"
"alpha-Eudesmol","C15H26O","C09663","11853"
"Betulinic acid","C30H48O3","C08619","10812"
"L787257","C17H13ClN2O2S","C11719","13884"
"Enalaprilate","C18H24N2O5","C11720","13885"
"Arabino-galactose","C11H20O10","C07285","9494"
"Oxymetazoline","C16H24N2O","C07363","9567"
"L791456","C18H15ClN2O2S","C11718","13883"
"Succinimide","C4H5NO2","C07273","9482"
"Nortriptyline","C19H21N","C07274","9483"
"Glutarimide","C5H7NO2","C07275","9484"
"Limonene-1,2-diol","C10H18O2","C07276","9485"
"dTDP-D-fucose","C16H26N2O15P2","C07277","9486"
"beta-D-Galactopyranosyl-(1->3)-N-acetyl-D-galactosamine","C14H25NO11","C07278","9487"
"2-Aminoethylarsonate","C2H8AsNO3","C07279","9488"
"Rhodanine","C3H3NOS2","C07280","9489"
"Obliquine","C26H28N2O5","C12183","14329"
"Trisphaeridine","C14H9NO2","C12182","14328"
"Ismine","C15H15NO3","C12181","14327"
"(-)-8-Demethylmaritidine","C16H19NO3","C12180","14326"
"Tazettine","C18H21NO5","C12179","14325"
"3-Epimacronine","C18H21NO6","C12178","14324"
"Proansamitocin","C25H33NO6","C12177","14323"
"Proansamycin X","C35H47NO10","C12176","14322"
"(E,E,E)-N-(2-Methylpropyl)hexadeca-2,6,8-trien-10-ynamide","C20H31NO","C08454","10647"
"Nangustine","C16H17NO4","C12185","14331"
"alpha-Naphthol","C10H8O","C11714","13879"
"Lachnophyllum ester","C11H12O2","C08453","10646"
"Succinyl proline","C9H13NO5","C11711","13876"
"Vicenin-2","C27H30O15","C10195","12381"
"Peonidin","C16H13O6+","C08726","10919"
"Pelargonin","C27H31O15+","C08725","10918"
"Safynol","C13H12O2","C08458","10651"
"1-Phenyl-5-heptene-1,3-diyne","C13H10","C08457","10650"
"N-Acetyl-O-demethylpuromycin","C23H29N7O6","C07031","9243"
"Cyanidin 3-O-rutinoside","C27H31O15+","C08620","10813"
"N-Acetyl-N6,O-didemethylpuromycin-5'-phosphate","C22H28N7O9P","C07029","9241"
"N-Acetyl-O-demethylpuromycin-5'-phosphate","C23H30N7O9P","C07030","9242"
"N6,N6,O-Trimethylpuromycin-5'-phosphate","C19H24N7O8P","C07027","9239"
"N-Acetyl-N6,N6,O-tridemethylpuromycin-5'-phosphate","C21H26N7O9P","C07028","9240"
"3'-Keto-3'-deoxy-AMP","C10H12N5O7P","C07025","9237"
"3'-Amino-3'-deoxy-AMP","C10H15N6O6P","C07026","9238"
"Granisetron","C18H24N4O","C07023","9235"
"3'-Keto-3'-deoxy-ATP","C10H14N5O13P3","C07024","9236"
"Kuwanone H","C45H44O11","C10100","12286"
"alpha-Amyrin","C30H50O","C08615","10808"
"Cyclohexane-1-carboxyl-CoA","C28H46N7O17P3S","C09823","12011"
"2-methyl-6-solanyl-1,4-benzoquinone","C52H82O2","",""
"octadec-9-ene-1,18-dioic-acid","C18H32O4","",""
"3b,12a-Dihydroxy-5b-cholanoic acid","C24H40O4","","738027"
"Hodgkinsine","C33H38N6","C09211","11402"
"2,6-Dihydroxycyclohexane-1-carboxyl-CoA","C28H46N7O19P3S","C09824","12012"
"3-(2'-methylthio)ethylmalic-acid","C7H12O5S","",""
"9,10-epoxy-18-hydroxystearate","C18H34O4","",""
"methylesterified 1,4-alpha-D-galacturonosyl","C19H28O19","",""
"D-methylmalonyl-CoA","C25H40N7O19P3S","",""
"1,4-alpha-D-galacturonosyl","C18H26O19","",""
"6-Oxo-2-hydroxycyclohexane-1-carboxyl-CoA","C28H44N7O19P3S","C09825","12013"
"dolichol-phosphate","C12H25O4P","",""
"N-Acetyl-D-glucosaminyldiphosphodolichol","C20H39NO12P2","",""
"Pinobanksin","C15H12O5","C09826","12014"
"Propane-1,3-diol","C3H8O2","C02457","5477"
"Sabinene hydrate","C10H18O","C02462","5479"
"Perillyl alcohol","C10H16O","C02452","5472"
"(Hydroxymethylphenyl)succinyl-CoA","C32H46N7O20P3S","C09819","12007"
"Phenylenediamine","C6H8N2","C02454","5474"
"1-Phenylethylamine","C8H11N","C02455","5475"
"N-Ethylmaleimide","C6H7NO2","C02441","5463"
"N-Methyltyramine","C9H13NO","C02442","5464"
"Nonane-4,6-dione","C9H16O2","C02445","5467"
"Benzoylsuccinyl-CoA","C32H44N7O20P3S","C09820","12008"
"Sodium bicarbonate","CHNaO3","C12603","582993"
"Olmesartan medoxomil","C29H30N6O6","C12604","582994"
"6-Ketoxycyclohex-1-ene-1-carboxyl-CoA","C28H42N7O18P3S","C09821","12009"
"Bisoxatin acetate","C24H19NO6","C12591","582981"
"Osutidine","C19H28N4O5S2","C12593","582983"
"Ferrous fumarate","C4H4FeO4","C12594","582984"
"Prothionamide","C9H12N2S","C12595","582985"
"Toborinone","C21H24N2O5","C12598","582988"
"Emtricitabine","C8H10FN3O3S","C12599","582989"
"Phenolsulfonphthalein","C19H14O5S","C12600","582990"
"Melinamide","C26H41NO","C12602","582992"
"Tebufenpyrad","C18H24ClN3O","C11126","13308"
"Asiatic acid","C30H48O5","C08617","10810"
"Acrifoline","C16H23NO2","C09850","12037"
"Delcosine","C24H39NO7","C08676","10869"
"Delcorine","C26H41NO7","C08675","10868"
"Delavaine A","C38H54N2O11","C08674","10867"
"Elatine","C38H50N2O10","C08681","10874"
"beta-Amyrin","C30H50O","C08616","10809"
"Annofoline","C16H25NO2","C09851","12038"
"Deltaline","C27H41NO8","C08679","10872"
"Delsoline","C25H41NO7","C08678","10871"
"Tripteroside","C19H18O11","C10095","12281"
"Annotine","C16H21NO3","C09852","12039"
"Ferulate","C10H10O4","C01494","4664"
"Farnesol","C15H26O","C01493","4663"
"Atropine","C17H23NO3","C01479","4651"
"Apigenin","C15H10O5","C01477","4649"
"Casein K","C5H10N2O2","C01483","4653"
"Caffeate","C9H8O4","C01481","4652"
"D-Allose","C6H12O6","C01487","4657"
"Chalcone","C15H12O","C01484","4654"
"D-Iditol","C6H14O6","C01489","4659"
"D-Apiose","C5H10O5","C01488","4658"
"Isoscutellarein","C15H10O6","C10097","12283"
"1,2-Dihydroxymint lactone","C10H14O4","C09853","12040"
"Liriodenine","C17H9NO3","C09567","11758"
"Hydroxyflutamide","C11H11F3N2O4","C14204","7847014"
"Serratanidine","C16H25NO4","C09899","12085"
"gamma-Terpinene","C10H16","C09900","12086"
"Sauroxine","C17H26N2O","C09895","12081"
"Rotundifolone","C10H14O2","C09896","12082"
"Selagine","C15H18N2O","C09897","12083"
"alpha-Terpinene","C10H16","C09898","12084"
"Oxolucidine B","C30H49N3O2","C09891","12077"
"Phlegmarine","C16H30N2","C09892","12078"
"Pulegone","C10H16O","C09893","12079"
"Pyrethrin II","C22H28O5","C09894","12080"
"Pregnan-21-ol","C21H36O","C00892","4148"
"Pregnan-21-al","C21H34O","C00891","4147"
"Pretazettine","C18H21NO5","C08536","10729"
"Dephospho-CoA","C21H35N7O13P2S","C00882","4138"
"Deoxycytidine","C9H13N3O4","C00881","4137"
"D-Galactonate","C6H12O7","C00880","4136"
"D-Galactarate","C6H10O8","C00879","4135"
"Pentanoyl-CoA","C26H44N7O17P3S","C00888","4144"
"Isochorismate","C10H10O6","C00885","4141"
"Homocarnosine","C10H16N4O3","C00884","4140"
"Galactomannan","C18H32O16","C00883","4139"
"Methoxybrassinin","C12H14N2OS2","C08506","10699"
"Norethindrone","C20H26O2","C05028","7499"
"Annotinine","C16H21NO3","C09855","12042"
"N3-Metyladenine","C6H9N5","C05026","7498"
"Amaranthin","C30H34N2O19","C08537","10730"
"o-Benzosemiquinone","C6H6O2","C05060","7518"
"Podorhizol beta-D-glucoside","C28H34O13","C10876","13059"
"m-Aminophenol","C6H7NO","C05058","7517"
"Ribulose","C5H10O5","C05052","7514"
"Carolinianine","C16H24N2O2","C09856","12043"
"Phosphinothricin","C5H12NO4P","C05042","7508"
"Delphinine","C33H45NO9","C08677","10870"
"Okadaic acid","C44H68O13","C01945","5049"
"4-Nitroacetophenone","C8H7NO3","C02803","5753"
"Oleandomycin","C35H61NO12","C01946","5050"
"Podophyllotoxone","C22H20O8","C10875","13058"
"Anhydrotetracycline","C22H22N2O7","C02811","5761"
"Selenocystathionine","C7H14N2O4Se","C05699","8006"
"Pentan-2-one","C5H10O","C01949","5052"
"Evodone","C10H12O2","C09858","12044"
"Kinamycin D","C22H18N2O9","C12394","582784"
"Nocardicin A","C23H24N4O9","C01941","5045"
"Lunacrine","C16H19NO3","C10711","12894"
"Nonanoyl-CoA","C30H52N7O17P3S","C01942","5046"
"Rugosal","C15H22O4","C09717","11905"
"beta-Santalene","C15H24","C09718","11906"
"Obtusifoliol","C30H50O","C01943","5047"
"Phomenone","C15H20O4","C09708","11897"
"Phytuberin","C17H26O4","C09709","11898"
"Randainol","C18H18O3","C10878","13061"
"Piperdial","C15H22O3","C09711","11900"
"Polygodial","C15H22O2","C09712","11901"
"Rhipocephalin","C21H28O6","C09714","11902"
"Rishitin","C14H22O2","C09715","11903"
"Dehydrorabelomycin","C19H12O5","C12390","582780"
"Premithramycin B","C53H72O24","C12388","582778"
"Betanin","C24H26N2O13","C08540","10733"
"L-2-Aminoadipate adenylate","C16H23N6O10P","C05560","7891"
"Imidazole-4-methanol","C4H6N2O","C05562","7892"
"delta(L-2-Aminoadipyl)-L-cysteinyl-D-valine","C14H25N3O6S","C05556","7889"
"Isopenicillin N","C14H21N3O6S","C05557","7890"
"Ergothioneine","C9H16N3O2S+","C05570","7896"
"Thiourocanic acid","C6H6N2O2S","C05571","7897"
"Melannin","C16H12O5","C10504","12687"
"(-)-Medicarpin","C16H14O4","C10503","12686"
"Prostalidin A","C21H14O8","C10877","13060"
"Verbascoside","C29H36O15","C10501","12684"
"1,3,4,5-Tetracaffeoylquinic acid","C43H36O18","C10500","12683"
"Suspensaside","C29H36O16","C10499","12682"
"Luteone","C20H18O6","C10498","12681"
"Subaphyllin","C14H20N2O3","C10497","12680"
"Sphagnum acid","C11H10O5","C10496","12679"
"Lotisoflavan","C17H18O5","C10495","12678"
"5'-Dehydroadenosine","C10H11N5O4","C11500","13670"
"9-Riburonosyladenine","C10H13N5O4","C11501","13671"
"(S)-2-Hydroxypropyl-CoM","C5H12O4S2","C11498","13668"
"(S)-3-Sulfolactate","C3H6O6S","C11499","13669"
"3-Hydroxy-2-methyl-1H-quinolin-4-one","C10H9NO2","C11504","13674"
"Propene","C3H6","C11505","13675"
"Mycothione","C34H58N4O24S2","C11502","13672"
"3-Hydroxy-1H-quinolin-4-one","C9H7NO2","C11503","13673"
"(R)-1,2-Epoxypropane","C3H6O","C11506","13676"
"(S)-1,2-Epoxypropane","C3H6O","C11507","13677"
"6-Hydroxydopamine","C8H11NO3","","249525"
"Capsicoside A","C63H106O35","C08889","11082"
"5-Methyltetrahydropteroyltri-L-glutamate","C25H36N8O12","C04489","7108"
"5-Methyl-5,6,7,8-tetrahydromethanopterin","C31H47N6O16P","C04488","7107"
"Guanosine 3'-diphosphate 5'-triphosphate","C10H18N5O20P5","C04494","7111"
"Xanthine","C5H4N4O2","C00385","3675"
"N-Acetyl-alpha-D-glucosamine 1-phosphate","C8H16NO9P","C04501","7115"
"N-(4-Guanidinobutyl)-4-hydroxycinnamide","C14H20N4O2","C04498","7113"
"Savinin","C20H16O6","C10880","13063"
"N'-Phosphoguanidinoethyl methyl phosphate","C4H13N3O7P2","C04503","7117"
"(1S,2S)-1,2-Dihydronaphthalene-1,2-diol","C10H10O2","C04514","7127"
"di-trans,poly-cis-Decaprenyl diphosphate","C50H84O7P2","C04509","7123"
"Alangimarine","C19H16N2O3","C09329","11520"
"Betalamic acid","C9H9NO5","C08538","10731"
"Maculosine","C17H17NO6","C10718","12901"
"Paeonoside","C15H20O8","C10717","12900"
"Maculosidine","C14H13NO4","C10716","12899"
"Paeonolide","C20H28O12","C10715","12898"
"Saucernetin","C22H28O5","C10879","13062"
"Rottlerin","C30H28O8","C10721","12904"
"Picein","C14H18O7","C10720","12903"
"Nordihydroguaiaretic acid","C18H22O4","C10719","12902"
"Melicopine","C17H15NO5","C10724","12907"
"Tricyclodehydroisohumulone","C21H28O5","C10723","12906"
"Erythromycin D","C36H65NO12","C06633","8859"
"Erythromycin E","C37H65NO14","C06634","8860"
"Alangimarckine","C29H37N3O3","C09328","11519"
"Oxmetidine","C19H21N5O3S","C11803","13967"
"Lamtidine","C18H28N6O","C11804","13968"
"4-Methylburimamide","C10H18N4S","C11801","13965"
"Oxaburimamide","C8H14N4OS","C11802","13966"
"SK&F 91581","C8H14N4S","C11799","13963"
"Thiaburimamide","C8H14N4S2","C11800","13964"
"Tifluadom","C22H20FN3OS","C11797","13961"
"4-Hydroxycyclophosphamide","C7H15Cl2N2O3P","C07643","9845"
"Loxtidine","C19H29N5O2","C11805","13969"
"Pantoprazole","C16H15F2N3O4S","C11806","13970"
"Sesamin","C20H18O6","C10882","13065"
"Nicotine-1'-N-oxide","C10H14N2O","","698442"
"3-Oxocholyl-CoA","C45H72N7O20P3S","","2011"
"Coumaphos syn-dimer","C28H32Cl2O10P2S2","C11027","13210"
"Paeonol","C9H10O3","C10712","12895"
"Schisantherin A","C30H32O9","C10881","13064"
"Alamarine","C19H18N2O4","C09326","11517"
"3-Hydroxyglutaric acid","C5H8O5","","759291"
"4-(N-Maleimido)phenyltrimethylammonium iodide","C13H15IN2O2","C13678","586270"
"4-(N-Maleimido)benzyltrimethylammonium iodide","C14H17IN2O2","C13677","586269"
"LY395153","C19H24N2O3S","C13676","586268"
"CX-516","C14H15N3O","C13675","586267"
"Dihydro-beta-erythroidine","C16H21NO3","C13682","586273"
"p-N,N-(Dimethylamino)phenyldiazonium fluoroborate","C8H10BF4N3","C13681","854006"
"Lophotoxin","C23H26O8","C13680","586272"
"Bis(3-azidopyridinium)-1,10-decane perchlorate","C20H28Cl2N8","C13679","586271"
"Clindamycin hydrochloride","C18H34Cl2N2O5S","C13684","586275"
"Histrionicotoxin","C19H25NO","C13683","586274"
"1-Diphosinositol pentakisphosphate","C6H19O27P7","C11174","13356"
"SN-38","C22H20N2O5","C11173","13355"
"Rhodamine 6G","C28H31ClN2O3","C11177","13358"
"S-(2,4-Dinitrophenyl)glutathione","C16H19N5O10S","C11175","13357"
"Pyronine Y","C17H19ClN2O","C11179","13360"
"Resazurin","C12H7NO4","C11178","13359"
"Proflavine","C13H11N3","C11181","13362"
"Pyrimethanil","C12H13N3","C11180","13361"
"Panipenem","C15H21N3O4S","C11183","13364"
"Prochloraz","C15H16Cl3N3O2","C11182","13363"
"Tetrahydrofolyl-[Glu](2)","C24H30N8O9","C09332","11523"
"Proparacaine","C16H26N2O3","C07383","9587"
"Tazanolast","C13H15N5O3","C13130","585194"
"Acephate","C4H10NO3PS","C14426","177039"
"(5R)-5-Hydroxyhexanoic acid","C6H12O3","",""
"Syrosingopine","C35H42N2O11","C13120","585184"
"Lormetazepam","C16H12Cl2N2O2","C13118","585182"
"Bucolome","C14H22N2O3","C13122","585186"
"Aceglutamide aluminum","C35H59Al3N10O24","C13121","585185"
"Quinine ethylcarbonate","C23H28N2O4","C13124","585188"
"Thiobencarb","C12H16ClNOS","C14428","175946"
"Bropirimine","C10H8BrN3O","C13127","585191"
"Voglibose","C10H21NO7","C13126","585190"
"Geranylgeranylacetone","C23H38O","C13297","586041"
"trans-L-3-Hydroxyproline","C5H9NO3","C05147","7565"
"Phenprobamate","C10H13NO2","C13294","586038"
"Phenthoate","C12H17O4PS2","C14429","160602"
"Clofenamide","C6H7ClN2O4S2","C13292","586036"
"Alclometasone dipropionate","C28H37ClO7","C13290","586034"
"Cefotiam hydrochloride","C18H25Cl2N9O4S3","C13289","586033"
"Proglumide","C18H26N2O4","C13288","586032"
"N-Nitrosodiethylamine","C4H10N2O","C14422","148735"
"Propafenone","C21H27NO3","C07381","9585"
"Fungichromin","C35H58O12","C13299","586043"
"1,8-Dinitropyrene","C16H8N2O4","C14423","180242"
"2-Ethylhydracrylic acid","C5H10O3","","766484"
"3a,6b,7a,12a-Tetrahydroxy-5b-cholanoic","C24H40O6","",""
"Multifidol","C11H14O4","C10709","12892"
"Bergenin","C14H16O9","C09919","12105"
"Heritonin","C16H18O3","C09936","12122"
"epi-Tulipinolide diepoxide","C17H22O6","C09568","11759"
"Sorbose 1-phosphate","C6H13O9P","C02888","5819"
"Brazilin","C16H14O5","C09920","12106"
"Catheduline E2","C38H40N2O11","C09935","12121"
"Miraxanthin-V","C17H18N2O6","C08557","10750"
"Oxymetholone","C21H32O3","C07393","9597"
"(+)-8-Hydroxycalamenene","C15H22O","C09938","12124"
"Ribothymidine","C10H14N2O6","","321639"
"Malvidin","C17H15O7+","C08716","10909"
"5,6,7-Trimethoxycoumarin","C12H12O5","C09313","11504"
"Pyrimethamine","C12H13ClN4","C07391","9595"
"Wyerone acid","C14H12O4","C08466","10659"
"Asimicin","C37H66O7","C08467","10660"
"Acremoauxin A","C16H21NO6","C08468","10661"
"Aristolochic acid","C17H11NO7","C08469","10662"
"Bullatacinone","C37H66O7","C08470","10663"
"Chalcogran","C9H16O2","C08471","10664"
"Avenanthramide A","C16H13NO5","C08472","10665"
"Monardaein","C42H41O23+","C08723","10916"
"Okanin","C15H12O6","C08724","10917"
"Matricin","C17H22O5","C09499","11690"
"Epidihydrocholesterin","C27H48O","C12978","583367"
"Lipiferolide","C17H22O5","C09497","11688"
"Linifolin A","C17H20O5","C09496","11687"
"Mexicanin E","C14H16O3","C09503","11694"
"Mellitoxin","C15H18O7","C09502","11693"
"Melampodinin","C25H30O12","C09501","11692"
"Melampodin A","C21H24O9","C09500","11691"
"Broussin","C16H16O3","C09505","11696"
"Mexicanin I","C15H18O4","C09504","11695"
"Propiomazine hydrochloride","C20H25ClN2OS","C07384","9588"
"3-benzoyloxypropyl-glucosinolate","C17H23NO11S2","",""
"Haemocorin","C32H34O14","C09932","12118"
"indolylmethyl glucosinolate aglycone","C10H10N2O4S2","",""
"N-acetylmuramoyl-L-alanyl-D-glutamyl-meso-2,6-diaminoheptane- D-alanyl-D-alanine-diphosphoundecaprenol","C77H127N7O23P2","",""
"undecaprenyl-pyrophosphoryl-MurNAc-(pentapeptide)-N-acetylglucosamine","C82H135N7O27P2","",""
"succinate-semialdehyde-thiamine PPi","C16H25N4O10P2S+","",""
"formyl-methanofuran","C35H44N4O16","",""
"D-carnitinyl-CoA","C28H50N8O18P3S+","",""
"3-methyl-4-cis-hydroxy-2-butenal","C5H8O2","",""
"indole carboxyl hydro-thiazole","C12H10N2O2S","",""
"Naphthazarin","C10H6O4","C01938","5043"
"Methotrexate","C20H22N8O5","C01937","5042"
"Indomethacin","C19H16ClNO4","C01926","5032"
"2'-Hydroxynicotine","C10H14N2O","","585023"
"L-Histidinal","C6H9N3O","C01929","5035"
"Isoflavanone","C15H12O2","C01927","5033"
"L-Norleucine","C6H13NO2","C01933","5038"
"L-Lysinamide","C6H15N3O","C01930","5036"
"Maltohexaose","C36H62O31","C01936","5041"
"L-Rhamnonate","C6H12O6","C01934","5039"
"N-Furfurylformamide","C6H7NO2","C02854","5792"
"N-Ethylglycocyamine","C8H17NO5","C02852","5790"
"N,N-Dimethylaniline","C8H11N","C02846","5785"
"Methyl ethyl ketone","C4H8O","C02845","5784"
"L-Octanoylcarnitine","C15H29NO4","C02838","5780"
"L-Lysine 1,6-lactam","C6H12N2O","C02837","5779"
"Imidazole-4-acetate","C5H6N2O2","C02835","5778"
"D-Phe-Pro-Arg-CH2Cl","C21H31ClN6O3","C02828","5775"
"N3'-Acetylapramycin","C23H43N5O12","C02856","5794"
"2S-Hydroxytetradecanoic acid","C14H28O3","C13790","854035"
"Ginkgetin","C32H22O10","C10048","12234"
"Geraldone","C16H12O5","C10047","12233"
"Genkwanin","C16H12O5","C10046","12232"
"Galangin 3,5,7-trimethyl ether","C18H16O5","C10045","12231"
"Galangin","C15H10O5","C10044","12230"
"Flavone","C15H10O2","C10043","12229"
"Fisetin 8-C-glucoside","C21H20O11","C10042","12228"
"Fisetin","C15H10O6","C10041","12227"
"4'-Hydroxy-3'-prenylacetophenone","C13H16O2","C10702","12885"
"N-(3-Oxohexanoyl)homoserine lactone","C10H15NO4","C11839","14001"
"Gossypetin 8-rhamnoside","C21H20O12","C10050","12236"
"Glepidotin A","C20H18O5","C10049","12235"
"Oxycarboxin","C12H13NO4S","C10956","13139"
"Canthiumine","C33H36N4O4","C10000","12186"
"Kokusaginine","C14H13NO4","C10701","12884"
"Cantleyine","C11H13NO3","C09933","12119"
"Thifensulfuron methyl","C12H13N5O6S2","C10957","13140"
"Aralionine A","C34H38N4O5","C09999","12185"
"Cycloprotobuxine C","C27H48N2","C10799","12982"
"Prinomide","C15H13N3O2","C10958","13141"
"Grevillol","C19H32O2","C10800","12983"
"Phosalone","C12H15ClNO4PS2","C11028","13211"
"Thenylchlor","C16H18ClNO2S","C10959","13142"
"N6-[(Indole-3-yl)acetyl]-L-lysine","C16H21N3O3","C04211","6884"
"all-trans-Heptaprenyl diphosphate","C35H60O7P2","C04216","6889"
"N-Benzoyl-4-hydroxyanthranilate","C14H11NO4","C04207","6880"
"N-Benzoyl-4-O-methoxyanthranilate","C15H13NO4","C04208","6881"
"N3-Oxalyl-L-2,3-diaminopropanoate","C5H8N2O5","C04209","6882"
"N5-(L-1-Carboxyethyl)-L-ornithine","C8H16N2O4","C04210","6883"
"L-Tyrosine methyl ester 4-sulfate","C10H13NO6S","C04201","6874"
"N,N-Dimethyl-1,4-phenylenediamine","C8H12N2","C04203","6876"
"N-(2,3-Dihydroxybenzoyl)-L-serine","C10H11NO6","C04204","6877"
"N-(3,4-Dichlorophenyl)-malonamate","C9H7Cl2NO3","C04205","6878"
"(-)-Sparteine","C15H26N2","C10783","12966"
"Cannabidiolic acid","C22H30O4","C10784","12967"
"Multiflorine","C15H22N2O","C10775","12958"
"Nuttalline","C15H24N2O2","C10776","12959"
"(-)-Ormosanine","C20H35N3","C10777","12960"
"Panamine","C20H33N3","C10778","12961"
"Piptanthine","C20H35N3","C10779","12962"
"Retamine","C15H26N2O","C10780","12963"
"Rhombifoline","C15H20N2O","C10781","12964"
"Sophoramine","C15H20N2O","C10782","12965"
"beta-Alanyl-L-arginine","C9H19N5O3","C05340","7718"
"Isodictamnine","C12H9NO2","C10697","12880"
"Indinavir sulfate","C36H49N5O8S","C08089","10289"
"Dienestrol","C18H18O2","C08090","10290"
"Delavirdine mesylate","C23H32N6O6S2","C08087","10287"
"Efavirenz","C14H9ClF3NO2","C08088","10288"
"Oseltamivir phosphate","C16H31N2O8P","C08093","10293"
"Rimantadine hydrochloride","C12H22ClN","C08094","10294"
"Nelfinavir mesylate","C33H49N3O7S2","C08091","10291"
"Oxaloacetate","C4H4O5","C00036","3338"
"Zanamivir","C12H20N4O7","C08095","10295"
"Cephalexin monohydrate","C16H19N3O5S","C08099","10299"
"Cinnamyl  acetate","C11H12O2","C12299","582690"
"Imidazolone","C3H4N2O","C06195","8445"
"2',3'-Cyclic GMP","C10H12N5O7P","C06194","8444"
"Guanosine 3'-phosphate","C10H14N5O8P","C06193","8443"
"ADPmannose","C16H25N5O15P2","C06192","8442"
"Hordenine","C10H15NO","C06199","8449"
"P1,P4-Bis(5'-uridyl) tetraphosphate","C18H26N4O23P4","C06198","8448"
"P1,P3-Bis(5'-adenosyl) triphosphate","C20H27N10O16P3","C06197","8447"
"2'-Deoxyinosine 5'-phosphate","C10H14N4O7P+","C06196","8446"
"Cypripedin","C16H12O5","C10323","12509"
"Salicylaldehyde","C7H6O2","C06202","8452"
"2,4-Dihydroxyhept-2-enedioate","C7H10O6","C06201","8451"
"Adouetine Y","C34H40N4O4","C09994","12180"
"Citronellyl acetate","C12H22O2","C12298","582689"
"(R,S)-Scoulerine","C19H21NO4","C12326","582716"
"4,5-Dihydroorotic acid","C5H6N2O4","","698395"
"Terbacil","C9H13ClN2O2","C10963","13146"
"5-Dodecenoic acid","C12H22O2","","728544"
"Adouetine X","C28H44N4O4","C09993","12179"
"beta-Terpinyl acetate","C12H20O2","C12301","582692"
"Haloxyfop methyl","C16H13ClF3NO4","C11031","13214"
"Muricholic acid","C24H40O5","","669724"
"10-Hydroxyloganin","C17H26O11","C11659","13824"
"8-Epiiridodial glucoside tetraacetate","C24H34O11","C11658","13823"
"Hamayne","C16H17NO4","C12164","14311"
"Powelline","C17H19NO4","C12163","14310"
"alpha-Terpinyl acetate","C12H20O2","C12300","582691"
"Myxalamid C","C24H37NO3","C12160","14307"
"Myxalamid B","C25H39NO3","C12159","14306"
"Crinine","C16H17NO3","C12162","14309"
"Myxalamid D","C23H35NO3","C12161","14308"
"Nystatin A3","C53H85NO20","C12156","14303"
"Nystatin A1","C47H75NO17","C12155","14302"
"Myxalamid A","C26H41NO3","C12158","14305"
"Myxalamid S","C25H41NO4","C12157","14304"
"Myristicin","C11H12O3","C10480","12663"
"Asperuloside tetraacetate","C26H30O15","C11655","13820"
"Valerianine","C11H15NO","C09991","12177"
"Idazoxan","C11H12N2O2","C10968","13151"
"5-Androstene-3b,16b,17a-triol","C19H30O3","",""
"[6]-Paradol","C17H26O3","C10482","12665"
"5b-Cholestane-3a,7a,12a,25-tetrol","C27H48O4","","745214"
"Orobanchoside","C29H36O16","C10481","12664"
"Phenethyl acetate","C10H12O2","C12303","582694"
"Novobiocin sodium","C31H35N2NaO11","C12609","582999"
"p-Methoxycinnamic acid ethyl ester","C12H14O3","C10476","12659"
"Kadsurenone","C21H24O5","C10638","12821"
"p-Methoxycinnamaldehyde","C10H10O2","C10475","12658"
"Carnosol","C20H26O4","C09069","11261"
"1,1-Bis(4-hydroxyphenyl)ethane","C14H14O2","C14349","4345083"
"Bisphenol A diglycidyl ether","C21H24O4","C14348","158804"
"Bisphenol A dimethacrylate","C23H24O4","C14345","653813"
"4',6-Dihydroxyflavone","C15H10O4","C14344","759714"
"Bisphenol A bis(2-hydroxyethyl)ether","C19H24O4","C14347","212361"
"BisPhenol A bis(chloroformate)","C17H14Cl2O4","C14346","217069"
"4,4'-Dihydroxybibenzyl","C14H14O2","C14341","657136"
"4-(2-Phenylethyl)phenol","C14H14O","C14340","657633"
"Trifluralin","C13H16F3N3O4","C14343","158635"
"3-Hydroxybiphenyl","C12H10O","C14342","154684"
"Isopropamide","C23H33N2O+","C07055","9267"
"Bellidifolin","C14H10O6","C10053","12239"
"gamma-Terpinyl acetate","C12H20O2","C12302","582693"
"Labetalol","C19H24N2O3","C07063","9275"
"Indinavir","C36H47N5O4","C07051","9263"
"Ipratropium","C20H30NO3+","C07052","9264"
"Isoetharine","C13H21NO3","C07053","9265"
"Calophyllin B","C18H16O4","C10054","12240"
"Lactulose","C12H22O11","C07064","9276"
"Gossypin","C21H20O13","C10051","12237"
"Undecylprodigiosin","C25H35N3O","C12023","14180"
"Athyriol","C14H10O6","C10052","12238"
"Phosphophosphinate","C6H15NO7P2","C12022","14179"
"Hinokiflavone","C30H18O10","C10057","12243"
"Alanylphosphate","C3H8NO5P","C12021","14178"
"Hispidulin","C16H12O6","C10058","12244"
"Methyl salicylate","C8H8O3","C12305","582696"
"Cethromycin","C42H59N3O10","C12020","14177"
"Dehydrocycloguanandin","C18H14O4","C10055","12241"
"Puromycin","C22H29N7O5","C01610","4763"
"2-Amino-9,10-epoxy-8-oxodecanoic acid","C10H17NO4","C12027","14184"
"Demethylbellidifolin","C13H8O6","C10056","12242"
"3,5-Dihydroxy-phenylglycine","C8H9NO4","C12026","14183"
"benzyladenine-7-N-glucoside","C18H21N5O5","",""
"cis-zeatin riboside monophosphate","C15H22N5O8P","",""
"5-dehydro episterol","C28H44O","",""
"benzyladenine-9-N-glucoside","C18H21N5O5","",""
"phenylacetothiohydroximate","C8H9NOS","",""
"2,6-Diamino-7-hydroxy-azelaic acid","C9H18N2O5","C12025","14182"
"campest-4-en-3beta-ol","C28H48O","",""
"24-methylenecholesterol","C28H46O","","668955"
"phosphoribulosylformimino-AICAR-P","C15H25N5O15P2","",""
"5alpha-campestan-3-one","C28H48O","",""
"Calcium-dependent antibiotic","C67H80N14O26","C12024","14181"
"Ginkgoic acid","C22H34O3","C10794","12977"
"Butyl acetate","C6H12O2","C12304","582695"
"(3R)-beta-Leucine","C6H13NO2","C02486","5499"
"(Ac)2-L-Lys-D-Ala","C13H23N3O5","C02487","5500"
"(+)-trans-Pulegol","C10H18O","C02484","5497"
"Geranylhy droquinone","C16H22O2","C10793","12976"
"2'-Hydroxydaidzein","C15H10O5","C02495","5507"
"2,4-Dinitrophenol","C6H4N2O5","C02496","5508"
"(R)-2-Ethylmalate","C6H10O5","C02488","5501"
"1-Methyladenosine","C11H15N5O4","C02494","5506"
"2-Butyne-1,4-diol","C4H6O2","C02497","5509"
"2-Ethylhexan-1-ol","C8H18O","C02498","5510"
"Skatole","C9H9N","C08313","10511"
"Aripiprazole","C23H27Cl2N3O2","C12564","582954"
"Cilnidipine","C27H28N2O7","C12573","582963"
"Fulvestrant","C32H47F5O3S","C12561","582951"
"Verteporfin","C41H42N4O8","C12562","582952"
"Gestonorone caproate","C26H38O4","C12559","582949"
"Saquinavir mesylate","C39H54N6O8S","C12560","582950"
"Cefepime hydrochloride","C19H28Cl2N6O6S2","C12557","582947"
"Furazabol","C20H30N2O2","C12558","582948"
"Potassium acetate","C2H3KO2","C12554","582944"
"Amelometasone","C26H35FO6","C12556","582946"
"Ellagic acid","C14H6O8","C10788","12971"
"Psilocin","C12H16N2O","C08312","10510"
"2,6-Dimethoxyphenol","C8H10O3","C10787","12970"
"Perillyl aldehyde","C10H14O","C02576","5571"
"N-Methylmescaline","C12H19NO3","C08310","10508"
"Spermine","C10H26N4","C00750","4012"
"Allyl cyclohexylpropionate","C12H20O2","C12306","582697"
"Catechol","C6H6O2","C00090","3390"
"4-Hydroxy-3-methoxy-benzaldehyde","C8H8O3","C00755","4017"
"Aurachin D","C25H33NO","C10641","12824"
"1-Octanol","C8H18O","C00756","4018"
"Calcium folinate","C20H21CaN7O7","C12611","583001"
"1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine","C12H15N","C04599","7196"
"(9Z,11E,13E)-Octadecatrienoic acid","C18H30O2","C08315","10513"
"Ketose","C6H12O6","C01383","4578"
"Hexose","C6H12O6","C01381","4576"
"Glycol","C2H6O2","C01380","4575"
"Fustin","C15H12O6","C01378","4573"
"Tacrolimus","C44H69NO12","C01375","4572"
"3'-UMP","C9H13N2O9P","C01368","4567"
"3'-AMP","C10H14N5O7P","C01367","4566"
"X-Trp","C11H11N2O2","C01365","4565"
"PQQH2","C14H8N2O8","C01359","4562"
"Mucin","C6H10O8","C01357","4560"
"Falaconitine","C34H47NO10","C08683","10876"
"Erythrophleguine","C25H39NO6","C08682","10875"
"2-Aminoacrylate","C3H5NO2","C02218","5284"
"2-Aminomuconate","C6H7NO4","C02220","5285"
"1-Methyladenine","C6H7N5","C02216","5282"
"10-Oxodecanoate","C10H18O3","C02217","5283"
"(+)-cis-Sabinol","C10H16O","C02213","5280"
"(E)-Glutaconate","C5H6O4","C02214","5281"
"beta-Alanopine","C6H9NO4","C02207","5275"
"Denudatine","C22H33NO2","C08680","10873"
"alpha-D-Xylose","C5H10O5","C02205","5273"
"alpha-Santonin","C15H18O3","C02206","5274"
"beta-Ocimene","C10H16","C09873","12059"
"Lycocernuine","C16H26N2O2","C09874","12060"
"Nerol","C10H18O","C09871","12057"
"Luciduline","C13H21NO","C09872","12058"
"(+)-beta-Phellandrene","C10H16","C09877","12063"
"Lycofawcine","C18H29NO4","C09878","12064"
"(R)-(-)-alpha-Phellandrene","C10H16","C09875","12061"
"Lycodine","C16H22N2","C09876","12062"
"Lycoflexine","C17H25NO2","C09879","12065"
"alpha-Pinene","C10H16","C09880","12066"
"Gentamicin C1a","C19H39N5O7","C00908","4163"
"5,6-Dihydrothymine","C5H8N2O2","C00906","4161"
"3-Methyladenine","C6H7N5","C00913","4168"
"Leukotriene A4","C20H30O3","C00909","4164"
"Cephalosporin C","C16H21N3O8S","C00916","4170"
"Benzyl viologen","C24H22N2+2","C00915","4169"
"Fenoxaprop ethyl","C18H16ClNO5","C11024","13207"
"Chloramphenicol","C11H12Cl2N2O5","C00918","4172"
"Dihydropteroate","C14H14N6O3","C00921","4175"
"CoA-glutathione","C31H51N10O21P3S2","C00920","4174"
"D-Galactosyl-3-N-acetyl-beta-D-galactosamine","C14H25NO11","C04610","7201"
"Butein","C15H12O5","C08578","10771"
"Tetracenomycin E","C22H16O8","C12370","582760"
"Antheraxanthin","C40H56O3","C08579","10772"
"Tetracenomycin A2","C23H18O8","C12371","582761"
"Tetracenomycin D3","C20H12O8","C12368","582758"
"(+)-Luguine","C19H13NO5","C09575","11766"
"Tetracenomycin B3","C21H14O8","C12369","582759"
"Coumaphos","C14H16ClO5PS","C11025","13208"
"Decarboxytetracenomycin F1","C19H14O5","C12374","582764"
"Tetracenomycin D3 methylester","C21H14O8","C12375","582765"
"Tetracenomycin M","C19H16O7","C12372","582762"
"Tetracenomycin F1 methylester","C21H16O7","C12373","582763"
"4-Chloroacetophenone","C8H7ClO","C06647","8873"
"Anisodamine","C17H23NO4","C10842","13025"
"4-Chlorobenzaldehyde","C7H5ClO","C06648","8874"
"6-Oxo-2-hydroxy-7-(4'-chlorophenyl)-3,8,8-trichloroocta-2E,4E,7E-trienoate","C14H8Cl4O4","C06645","8871"
"D-erythro-3-Methylmalate","C5H8O5","C06032","8304"
"Tos-Arg-CH2Cl","C13H21ClN4O2S","C02087","5172"
"6-Oxo-2-hydroxy-7-(4'-chlorophenyl)-3,8,8,8-tetrachloroocta-2E,4E-dienoate","C14H9Cl5O4","C06651","8877"
"Heliotrine","C16H27NO5","C10324","12510"
"Erythromycin B","C37H67NO12","C06653","8878"
"Dioscorine","C13H19NO2","C10142","12328"
"DMDP","C6H13NO4","C10143","12329"
"Fagomine","C6H13NO3","C10144","12330"
"Funebrine","C18H24N2O5","C10145","12331"
"Fusaric acid","C10H13NO2","C10146","12332"
"Gerrardine","C11H19NO2S4","C10147","12333"
"Girgensonine","C13H16N2O","C10148","12334"
"Guvacine","C6H9NO2","C10149","12335"
"Harzianopyridone","C14H19NO5","C10150","12336"
"3-Hydroxystachydrine","C7H13NO3","C10151","12337"
"2,3-Dihydroxy 1,1,1-Trichloro-2,2-bis(4'-chlorophenyl)ethane","C14H9Cl5O2","C06650","8876"
"Rutamarin","C21H24O5","C09308","11499"
"Ecgonine methyl ester","C10H17NO3","C12448","582838"
"2,4-DP","C9H8Cl2O3","C11020","13203"
"SC-1271","C18H15ClN2O4","C10969","13152"
"3,4,3'-Tri-O-methylellagic acid","C17H12O8","C10836","13019"
"Fluperlapine","C19H20FN3","C10967","13150"
"Chlorpromazine N-oxide","C17H19ClN2OS","C10966","13149"
"Thiadiazolidinone","C12H12BrN3OS","C10973","13156"
"Imide","C14H12BrNO2","C10972","13155"
"Isoimide","C14H12BrNO2","C10971","13154"
"SK&F 86466","C11H14ClN","C10970","13153"
"Triazolidinonethione","C12H12BrN3OS","C10975","13158"
"Trichlopyr","C7H4Cl3NO3","C11032","13215"
"Phenethyl caffeate","C17H16O4","C10484","12667"
"Phaseolic acid","C13H12O8","C10483","12666"
"Chaparrin","C20H28O7","C08756","10949"
"Zizyphine F","C32H47N5O6","C10016","12202"
"Pseudoecgonine","C9H15NO3","C12449","582839"
"Zizyphine A","C33H49N5O6","C10015","12201"
"Auramycinone","C21H18O8","C12419","582809"
"Diclofop methyl","C16H14Cl2O4","C11021","13204"
"Amentoflavone","C30H18O10","C10018","12204"
"Trichocarpin","C20H22O9","C10835","13018"
"7-O-beta-D-Glucosyl-5,7,4'-trihydroxyflavone","C21H20O10","C04608","7199"
"5-(3,4-Diacetoxybut-1-ynyl)-2,2'-bithiophene","C16H14O4S2","C04606","7198"
"3-Hydroxy-2-methylpyridine-4,5-dicarboxylate","C8H7NO5","C04604","7197"
"6-Hydroxyprotopine","C20H19NO6","C05190","7595"
"1,2-Bis(3,4-dimethoxyphenyl)propane-1,3-diol","C19H24O6","C04597","7194"
"1,1-Dichloro-2,2-bis(4-chlorophenyl)ethylene","C14H8Cl4","C04596","7193"
"(9Z)-(13S)-12,13-Epoxyoctadeca-9,11-dienoic acid","C18H30O3","C04594","7192"
"(2S,3R)-3-Hydroxybutane-1,2,3-tricarboxylate","C7H10O7","C04593","7191"
"Pandamine","C31H44N4O5","C10012","12198"
"Indole-3-ylacetyl-myo-inositol L-arabinoside","C21H27NO11","C04611","7202"
"Nummularine F","C23H32N4O4","C10011","12197"
"4-Dedimethyl-6-dehydro-anhydrotetracycline","C20H18N2O7","C06654","8879"
"L-N2-(2-Carboxyethyl)arginine","C9H18N4O4","C06655","8880"
"Vermeerin","C15H20O4","C09574","11765"
"Scutianine F","C38H45N5O5","C10014","12200"
"L-threo-3-Methylmalate","C5H8O5","C06029","8301"
"Methyloxaloacetate","C5H6O5","C06030","8302"
"D-threo-3-Methylmalate","C5H8O5","C06031","8303"
"Berbamunine","C36H40N2O6","C05177","7588"
"Di[3-deoxy-D-manno-octulosonyl]-lipid IV(A)","C84H154N2O37P2","C06025","8297"
"Di[3-deoxy-D-manno-octulosonyl]-lipid A","C110H202N2O39P2","C06026","8298"
"L-erythro-3-Methylmalyl-CoA","C26H44N7O20P3S","C06027","8299"
"Mesaconyl-CoA","C26H40N7O19P3S","C06028","8300"
"Triasulfuron","C14H16ClN5O5S","C10961","13144"
"Cabucine","C22H26N2O4","C10904","13087"