Sf_category,Sf_framecode,Entry_ID,Sf_ID,ID,BMRB_code,Name,Type,Polymer_common_type,Polymer_type,Polymer_type_details,Polymer_strand_ID,Polymer_seq_one_letter_code_can,Polymer_seq_one_letter_code,Target_identifier,Polymer_author_defined_seq,Polymer_author_seq_details,Ambiguous_conformational_states,Ambiguous_chem_comp_sites,Nstd_monomer,Nstd_chirality,Nstd_linkage,Nonpolymer_comp_ID,Nonpolymer_comp_label,Number_of_monomers,Number_of_nonpolymer_components,Paramagnetic,Thiol_state,Src_method,Parent_entity_ID,Fragment,Mutation,EC_number,Calc_isoelectric_point,Formula_weight,Formula_weight_exptl,Formula_weight_exptl_meth,Details,DB_query_date,DB_query_revised_last_date
entity,1_3_diaminopropane,bmse000001,4,1,,1-3-diaminopropane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_3_diphospho_D_glyceric_acid,bmse000002,27,1,,"2,3-diphospho-D-glyceric acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_deoxyguanosine,bmse000003,52,1,,2'-Deoxyguanosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ADP,bmse000004,73,1,,ADP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,AMP,bmse000005,101,1,,AMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ATP,bmse000006,126,1,,ATP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_3_phosphoglyceric_acid,bmse000007,152,1,,D-(-)-3-phosphoglyceric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_allose,bmse000008,174,1,,D-allose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_fructose,bmse000010,196,1,,D-(-)-Fructose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_fructose_1_6_bisphosphate,bmse000011,220,1,,"D-fructose-1,6-bisphosphate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_fructose_6_phosphate,bmse000012,241,1,,D-fructose-6-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_galactose,bmse000013,268,1,,D-(+)-Galactose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucose,bmse000015,291,1,,D-(+)-Glucose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucose_6_phosphate,bmse000016,316,1,,D-Glucose 6-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_maltose,bmse000017,338,1,,D-(+)-maltose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_mannose,bmse000018,362,1,,D-(+)-Mannose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_ornithine,bmse000019,385,1,,D-ornithine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_psicose,bmse000020,409,1,,D-Psicose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_sorbose,bmse000022,431,1,,D-(+)-Sorbose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_tagatose,bmse000023,454,1,,D-(-)-Tagatose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_threo_isocitric_acid,bmse000025,478,1,,D-(+)-threo-isocitric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_xylose,bmse000026,500,1,,D-(+)-xylose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_xylulose,bmse000027,524,1,,D-Xylulose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_alanine,bmse000028,545,1,,L-alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arginine,bmse000029,568,1,,L-arginine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_asparagine,bmse000030,593,1,,L-asparagine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_aspartic_acid,bmse000031,618,1,,L-aspartic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_citrulline,bmse000032,641,1,,L-citrulline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_cystathionine,bmse000033,666,1,,L-cystathionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_cysteine,bmse000034,688,1,,L-cysteine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_cystine,bmse000035,712,1,,L-cystine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_fucose,bmse000036,739,1,,L-(-)-fucose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutamic_acid,bmse000037,761,1,,L-glutamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutamine,bmse000038,786,1,,L-glutamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_histidine,bmse000039,809,1,,L-histidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_homoserine,bmse000040,830,1,,L-homoserine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_isoleucine,bmse000041,852,1,,L-isoleucine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_leucine,bmse000042,875,1,,L-leucine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_lysine,bmse000043,899,1,,L-lysine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_methionine,bmse000044,923,1,,L-methionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_phenylalanine,bmse000045,948,1,,L-phenylalanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,malic_acid,bmse000046,973,1,,malic_acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_proline,bmse000047,997,1,,L-proline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_serine,bmse000048,1021,1,,L-serine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_threonine,bmse000049,1042,1,,L-threonine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_tryptophan,bmse000050,1063,1,,L-tryptophan,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_tyrosine,bmse000051,1083,1,,L-tyrosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_valine,bmse000052,1111,1,,L-valine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,NAD,bmse000053,1132,1,,NAD,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,NADH,bmse000054,1158,1,,NADH,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,NADPH,bmse000055,1186,1,,NADPH,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_D_mannosamine,bmse000056,1213,1,,N-Acetyl-D-mannosamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetylneuraminic_acid,bmse000057,1235,1,,N-Acetylneuraminic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,O_succinyl_L_homoserine,bmse000058,1257,1,,O-succinyl-L-homoserine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S_adenosyl_L_methionine,bmse000059,1279,1,,s-(5'-adenosyl)-L-methionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adenine,bmse000060,1300,1,,adenine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adenosine,bmse000061,1327,1,,adenosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adonitol,bmse000062,1353,1,,adonitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,agmatine,bmse000063,1376,1,,agmatine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,xanthosine,bmse000128,2708,1,,xanthosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_ketoglutaric_acid,bmse000064,1400,1,,alpha-ketoglutaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lactose,bmse000065,1425,1,,Lactose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_aminobenzoic_acid,bmse000066,1449,1,,4-aminobenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,anthranilic_acid,bmse000067,1472,1,,anthranilic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arabitol,bmse000068,1495,1,,L-(-) arabitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,betaine,bmse000069,1517,1,,betaine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,betaine_aldehyde,bmse000070,1541,1,,Betaine aldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cAMP,bmse000071,1563,1,,cyclic AMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cadaverine,bmse000072,1585,1,,"1,5-Diaminopentane",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_canavanine,bmse000073,1605,1,,L-Canavanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_carnitine,bmse000074,1628,1,,D-Carnitine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,chorismic_acid,bmse000075,1652,1,,chorismic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,citrate,bmse000076,1674,1,,citrate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,coumarin,bmse000077,1698,1,,coumarin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,creatine,bmse000078,1720,1,,creatine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,creatine_phosphate,bmse000079,1744,1,,creatine phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dehydro_proline,bmse000080,1765,1,,"3,4-dehydro-d/L-proline",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,fumaric_acid,bmse000083,1787,1,,sodium fumarate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,gluconic_acid,bmse000084,1809,1,,gluconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_D_glucose_1_phosphate,bmse000086,1831,1,,alpha-d-glucose-1-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_D_glucose_1_6_bisphosphate,bmse000087,1853,1,,"alpha-D-Glucose 1,6-bisphosphate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycine,bmse000089,1875,1,,glycine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,guanine,bmse000090,1898,1,,guanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,guanosine,bmse000091,1920,1,,guanosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_hydroxybenzoic_acid,bmse000092,1947,1,,4-hydroxy-benzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trans_3_hydroxycinnamic_acid,bmse000093,1968,1,,trans-3-Hydroxycinnamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,hypoxanthine,bmse000094,1990,1,,hypoxanthine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,i_erythritol,bmse000095,2012,1,,i-erythritol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,imidazole,bmse000096,2034,1,,imidazole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,indole,bmse000097,2056,1,,indole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,inosine,bmse000098,2078,1,,inosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_mannitol,bmse000099,2103,1,,D-Mannitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,meso_erythritol,bmse000100,2125,1,,meso-erythritol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl_oxobutanoic_acid,bmse000101,2147,1,,3-methyl-2-oxobutinoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,muco_inositol,bmse000102,2169,1,,muco-inositol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,myo_inositol,bmse000103,2191,1,,myo-inositol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,niacin,bmse000104,2214,1,,nicotinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,nicotine,bmse000105,2236,1,,(+/-) nicotine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,oxalate,bmse000106,2258,1,,oxalate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phosphoenolpyruvic_acid,bmse000107,2276,1,,phosphoenolpyruvic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,prephenic_acid,bmse000108,2297,1,,prephenic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,putrescine,bmse000109,2318,1,,"putrescine (1,4 diaminobutane)",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,pyridoxal,bmse000110,2340,1,,pyridoxal,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,pyridoxal_5_phosphate,bmse000111,2362,1,,pyridoxal-5-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,pyruvic_acid,bmse000112,2383,1,,Pyruvic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,scyllo_inositol,bmse000113,2406,1,,scyllo-Inosoitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,shikimic_acid,bmse000114,2428,1,,shikimic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_sorbitol,bmse000115,2451,1,,D-sorbitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,spermidine,bmse000116,2473,1,,spermidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,spermine,bmse000117,2494,1,,spermine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000118,2514,1,,succinic acid disodium salt,non-polymer,,,,,,,,,,N,N,,N,N,,,,,,,,,,,,,,,,,,
entity,sucrose,bmse000119,2531,1,,sucrose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,taurine,bmse000120,2553,1,,taurine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_threitol,bmse000121,2575,1,,L-(-)-threitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trans_4_hydroxy_L_proline,bmse000123,2597,1,,trans 4 hydroxy l proline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trans_cinnamic_acid,bmse000124,2623,1,,trans-cinnamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_trehalose,bmse000125,2645,1,,D-Trehalose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,uric_acid,bmse000126,2668,1,,uric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,xanthine,bmse000127,2685,1,,xanthine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,xylitol,bmse000129,2729,1,,xylitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,pyridoxamine,bmse000130,2752,1,,pyridoxamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,pyridoxamine_5_phosphate,bmse000131,2774,1,,pyridoxamine-5-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,homovanillic_acid,bmse000132,2796,1,,homovanillic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,isonicotinic_acid,bmse000133,2818,1,,isonicotinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ethacrynic_acid,bmse000134,2840,1,,ethacrynic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cyanuric_acid,bmse000135,2862,1,,cyanuric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,itaconic_acid,bmse000137,2880,1,,itaconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_cellobiose,bmse000138,2901,1,,D-cellobiose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,amygdalin,bmse000139,2925,1,,Amygdalin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucuronate,bmse000140,2947,1,,D-Glucuronate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,gamma_D_galactonolactone,bmse000141,2969,1,,"D-Galactono-1,4-lactone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylcarnitine,bmse000142,2991,1,,(+-)-Acetylcarnitine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5_acetylamido_2_chloroaniline,bmse000143,3013,1,,5-Acetylamido-2-chloroaniline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dihydroxyacetone,bmse000144,3034,1,,Dihydroxyacetone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_L_glutamine,bmse000145,3055,1,,N-acetyl-L-Glutamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ADA,bmse000146,3080,1,,N-(2-Acetamido)iminodiacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_aminoantipyrine,bmse000147,3100,1,,4-Aminoantipyrine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,diethyl_oxalacetate,bmse000148,3121,1,,Diethyl oxalacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_hydroxycinnamic_acid,bmse000150,3141,1,,4-Hydroxycinnamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_D_galactose_1_phosphate,bmse000151,3162,1,,alpha-D-Galactose 1-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trigonelline,bmse000152,3184,1,,Trigonelline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_methionine_methylsulfonium_iodide,bmse000153,3206,1,,L-methionine methylsulfonium iodide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_2_aminoethyl_morpholine,bmse000154,3228,1,,4-(2-Aminoethyl)morpholine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,creatinine,bmse000155,3249,1,,Creatinine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trimethyl_phosphonoacetate,bmse000156,3273,1,,trimethyl phosphonoacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_L_alanine,bmse000157,3294,1,,N-Acetyl-L-Alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,uridine,bmse000158,3316,1,,Uridine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,beta_alanine,bmse000159,3339,1,,beta-alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,sarcosine,bmse000160,3363,1,,Sarcosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3_hydroxybutyrate,bmse000161,3384,1,,3-hydroxybutyrate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_ornithine,bmse000162,3409,1,,L-Ornithine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_D_glucosamine_1_phosphate,bmse000163,3430,1,,N-Acetyl-alpha-D-glucosamine 1-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_xylonate_cadmium,bmse000166,3452,1,,D-Xylonate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_tartaric_acid,bmse000167,3474,1,,L-Tartaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylcholine,bmse000168,3496,1,,Acetylcholine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_selenomethionine,bmse000169,3517,1,,L(+)-Selenomethionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutathione_oxidized,bmse000170,3539,1,,"L(-)-Glutathione, oxidized",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1_amino_1_phenylmethyl_phosphonic_acid,bmse000171,3562,1,,(1-amino-1-phenylmethyl)phosphonic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_kynurenine,bmse000172,3583,1,,L-Kynurenine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_hydroxyphenethyl_alcohol,bmse000173,3605,1,,4-Hydroxyphenethyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5_acetylamino_2_nitrobenzoic_acid,bmse000174,3626,1,,5-(acetylamino)-2-nitrobenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,inosine_5_monophosphate,bmse000175,3647,1,,Inosine 5'-monophosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_amino_5_ethyl_1_3_4_thiadiazole,bmse000176,3669,1,,"2-Amino-5-ethyl-1,3,4-thiadiazole",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,indole_3_acetic_acid,bmse000177,3689,1,,Indole-3-Acetic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_naphthoic_acid,bmse000178,3711,1,,alpha-naphthoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,propionic_acid,bmse000179,3732,1,,Propionic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cytosine,bmse000180,3753,1,,Cytosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-ascorbate,bmse000182,3774,1,,(+)-Sodium L-ascorbate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,succinic_acid,bmse000183,3796,1,,Succinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycerol,bmse000184,3819,1,,Glycerol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutathione_reduced,bmse000185,3842,1,,L-Glutathione reduced,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,uracil,bmse000187,3868,1,,Uracil,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,uridine_5_diphospho_N_acetlyglucosamine,bmse000188,3888,1,,Uridine 5'-Diphospho-N-Acetlyglucosamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ITP,bmse000255,5152,1,,ITP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucosamine_6_phosphate,bmse000189,3908,1,,D-Glucosamine 6-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cytidine,bmse000190,3930,1,,Cytidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetic_acid,bmse000191,3955,1,,Acetic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL_alpha_glycerol_phosphate,bmse000193,3980,1,,DL-alpha-Glycerol phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arginine_L_glutamate,bmse000194,4002,1,,L-Arginine L-Glutamate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_alpha_acetyl_DL_ornithine,bmse000195,4024,1,,N(alpha)-Acetyl-DL-Ornithine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl_N_acetyl_alpha_D_glucosaminide,bmse000196,4046,1,,Methyl N-acetyl-alpha-D-glucosaminide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,6_phosphogluconic_acid,bmse000198,4068,1,,6-Phosphogluconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,citraconic_acid,bmse000199,4090,1,,citraconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,homogentisic_acid,bmse000200,4112,1,,homogentisic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,kanamycin,bmse000201,4134,1,,Kanamycin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,HEPES,bmse000202,4157,1,,HEPES,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,formate,bmse000203,4179,1,,Sodium Formate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_ribose_5_phosphate,bmse000204,4201,1,,D-Ribose 5-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_D_glucosamine_6_phosphate,bmse000205,4222,1,,N-Acetyl-D-glucosamine 6-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,caffeine,bmse000206,4244,1,,Caffeine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,tryptamine,bmse000207,4266,1,,Tryptamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_lactic_acid,bmse000208,4288,1,,L-(+) lactic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_citrulline,bmse000209,4310,1,,D-Citrulline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_deoxyguanosine_5_triphosphate,bmse000210,4331,1,,2'-Deoxyguanosine 5'-triphosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_carnitine,bmse000211,4352,1,,L(-)-Carnitine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,maleic_acid,bmse000212,4373,1,,Maleic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arabinose,bmse000213,4396,1,,L-(+)-Arabinose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_galacturonic_acid,bmse000216,4418,1,,D-Galacturonic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,quinolinic_acid,bmse000219,4440,1,,quinolinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phenylacetic_acid,bmse000220,4462,1,,phenylacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,raffinose,bmse000221,4484,1,,raffinose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL_serine,bmse000222,4506,1,,DL-Serine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_nitrophenol,bmse000223,4528,1,,4-Nitrophenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trimethylamine,bmse000224,4549,1,,Trimethylamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_L_glyceraldehyde,bmse000225,4570,1,,"D,L-Glyceraldehyde",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,FAD,bmse000226,4591,1,,FAD,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,biotin,bmse000227,4612,1,,(+)-Biotin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,polygalacturonic_acid,bmse000228,4635,1,,Polygalacturonic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucono_1_5_lactone,bmse000230,4657,1,,"D-Glucono-1,5-lactone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_D_glucosamine,bmse000231,4679,1,,N-acetyl-D-glucosamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycogen,bmse000232,4701,1,,Glycogen,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,melibiose,bmse000233,4722,1,,alpha-D (+) Melibiose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_gulonolactone,bmse000235,4743,1,,L-Gulonolactone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_alanine,bmse000236,4765,1,,D-Alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL_pipecolic_acid,bmse000237,4786,1,,DL-pipecolic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_malic_acid,bmse000238,4808,1,,L-malic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_saccharate,bmse000239,4830,1,,D-Saccharate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,stachyose,bmse000240,4852,1,,Stachyose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_N_dimethylglycine,bmse000241,4874,1,,"N,N-Dimethylglycine",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,isethionic_acid,bmse000242,4895,1,,Isethionic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,tyramine,bmse000243,4916,1,,Tyramine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,thymidine,bmse000244,4939,1,,thymidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycolate,bmse000245,4961,1,,Sodium glycolate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_carnosine,bmse000246,4982,1,,L-carnosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucosamine,bmse000247,5004,1,,D-Glucosamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1_3_dimethylurea,bmse000248,5025,1,,"1,3-Dimethylurea",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl_4_aminobutyrate,bmse000249,5048,1,,Methyl 4-aminobutyrate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dAMP,bmse000250,5069,1,,dAMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Salicylate,bmse000252,5091,1,,Salicylate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dADP,bmse000253,5112,1,,dADP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_Fructose_1_phosphate,bmse000254,5130,1,,D-Fructose 1-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Formaldehyde,bmse000256,5173,1,,Formaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,FMN,bmse000257,5196,1,,FMN,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Glycolaldehyde,bmse000258,5217,1,,Glycolaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_Hydroxybenzaldehyde,bmse000259,5238,1,,4-Hydroxybenzaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Nicotinamide_D_ribonucleotide,bmse000260,5260,1,,Nicotinamide D-ribonucleotide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetyl_phosphate,bmse000261,5280,1,,Acetyl phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3_4_Hydroxyphenyl_pyruvate,bmse000262,5301,1,,3-(4-Hydroxyphenyl)pyruvate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,NADP,bmse000263,5321,1,,NADP+,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_Nitrophenyl_phosphate,bmse000264,5342,1,,4-Nitrophenyl phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_Nitrocatechol,bmse000265,5364,1,,4-Nitrocatechol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UDP,bmse000266,5386,1,,UDP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Formamide,bmse000267,5407,1,,Formamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,R_Lactate,bmse000269,5430,1,,(R)-Lactate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,GDP,bmse000270,5451,1,,GDP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,CoA,bmse000271,5472,1,,CoA,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,CDP,bmse000272,5491,1,,CDP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_Aspartate,bmse000273,5513,1,,D-Aspartate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Thiamin,bmse000274,5535,1,,Thiamin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_Fructose_2_6_bisphosphate,bmse000275,5556,1,,"D-Fructose 2,6-bisphosphate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ethanolamine,bmse000276,5578,1,,Ethanolamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,CTP,bmse000277,5601,1,,CTP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_Ribulose_5_phosphate,bmse000278,5623,1,,D-Ribulose 5-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Urocanate,bmse000279,5644,1,,Urocanate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UMP,bmse000280,5665,1,,UMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Nicotinamide,bmse000281,5686,1,,Nicotinamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL_Alanine,bmse000282,5707,1,,Alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Orotate,bmse000283,5727,1,,Orotate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Benzonitrile,bmse000284,5748,1,,Benzonitrile,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Choline,bmse000285,5770,1,,Choline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetophenone,bmse000286,5794,1,,Acetophenone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pantothenate,bmse000287,5816,1,,Pantothenate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pyridoxine,bmse000288,5837,1,,Pyridoxine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S_Adenosyl_L_homocysteine,bmse000289,5858,1,,S-Adenosyl-L-homocysteine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phenol,bmse000290,5880,1,,Phenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Selenomethionine,bmse000291,5903,1,,Selenomethionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UDPglucuronate,bmse000292,5924,1,,UDPglucuronate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Hydroquinone,bmse000293,5945,1,,Hydroquinone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methanol,bmse000294,5968,1,,Methanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UTP,bmse000295,5990,1,,UTP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dTMP,bmse000296,6011,1,,dTMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ethanol,bmse000297,6031,1,,Ethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_Glyceraldehyde,bmse000298,6053,1,,D-Glyceraldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Folate,bmse000299,6075,1,,Folate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Benzoate,bmse000300,6100,1,,Benzoate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1_2_Propanediol,bmse000302,6122,1,,"1,2-Propanediol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1_3_Propanediol,bmse000303,6144,1,,"1,3-Propanediol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000304,6165,1,,"1,4-Benzoquinone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1-amino-2-propanol,bmse000305,6185,1,,1-amino-2-propanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000306,6207,1,,"(1R,3R,4R,5R)-(-)-Quinic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Amino-1-phenylethanol,bmse000307,6229,1,,2-Amino-1-phenylethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Aminoethyl,bmse000308,6252,1,,2-Aminoethyl dihydrogen phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Aminoethylphosphonic,bmse000309,6273,1,,2-Aminoethylphosphonic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Aminophenol,bmse000310,6294,1,,2-Aminophenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Cytidine-5-monophosphate,bmse000311,6316,1,,Cytidine-5'-monophosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,6-aminopenicillanic,bmse000312,6338,1,,6-aminopenicillanic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,beta-gentiobiose,bmse000313,6360,1,,beta-gentiobiose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,d-desthiobiotin,bmse000314,6382,1,,d-desthiobiotin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D-Salicin,bmse000315,6404,1,,D-Salicin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Epinephrine,bmse000316,6426,1,,Epinephrine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,nonactin,bmse000763,15921,1,,nonactin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Gibberellic,bmse000317,6448,1,,Gibberellic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Sinapic,bmse000318,6470,1,,Sinapic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,(+-)-3-Methyl-2-oxopentanoic,bmse000319,6492,1,,(+-)-3-Methyl-2-oxopentanoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Deoxyuridine,bmse000320,6514,1,,2'-Deoxyuridine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Hydroxyanthranilic,bmse000321,6534,1,,3-Hydroxyanthranilic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000322,6556,1,,"3,4-Dihydroxy-L-phenylalanine",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_Deoxycytidine,bmse000323,6578,1,,2'-Deoxycytidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-hydroxybenzoic,bmse000324,6601,1,,3-hydroxybenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-ketobutyric,bmse000325,6623,1,,2-ketobutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000326,6644,1,,"2,5-dihydroxybenzoic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000327,6667,1,,"3,5-Diiodo-L-tyrosine",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000328,6689,1,,"3,4-Dihydroxybenzoic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000329,6711,1,,"3,4-Dihydroxyphenylacetic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Furoic,bmse000330,6733,1,,2-Furoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-(2-Hydroxyphenyl)propionic,bmse000331,6755,1,,3-(2-Hydroxyphenyl)propionic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Chlorobenzoic,bmse000332,6777,1,,2-Chlorobenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Ureidopropionic,bmse000333,6799,1,,3-Ureidopropionic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Methylcatechol,bmse000334,6821,1,,3-Methylcatechol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Hydroxy-3-methylglutaric,bmse000335,6844,1,,3-Hydroxy-3-methylglutaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000336,6865,1,,"3,5-dichlorocatechol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Iodo_L-tyrosine,bmse000337,6887,1,,3-Iodo_L-tyrosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Hydroxyisocaproic,bmse000338,6910,1,,2-Hydroxyisocaproic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-hydroxyphenylacetic,bmse000339,6932,1,,3-hydroxyphenylacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,gamma-Aminobutyric,bmse000340,6954,1,,gamma-Aminobutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,6-Hydroxynicotinic,bmse000341,6975,1,,6-Hydroxynicotinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-Dihydroorotic,bmse000342,6997,1,,L-Dihydroorotic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,vanillin,bmse000343,7020,1,,vanillin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Guanidinobutyric,bmse000344,7043,1,,4-Guanidinobutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Valeric,bmse000345,7065,1,,Valeric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Barbituric,bmse000346,7086,1,,Barbituric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trans-2-Hydroxycinnamic,bmse000347,7107,1,,trans-2-Hydroxycinnamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000348,7128,1,,DL-3-aminoisobutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Adenosine_3_monophosphate,bmse000349,7141,1,,Adenosine-3'-monophosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,m-Cresol,bmse000350,7163,1,,m-Cresol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Hexanoic,bmse000351,7186,1,,Hexanoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL-threo-beta-Methylaspartate,bmse000352,7207,1,,DL-threo-beta-Methylaspartate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Nepsilon-Acetyl-L-lysine,bmse000353,7229,1,,Nepsilon-Acetyl-L-lysine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pimelic,bmse000354,7252,1,,Pimelic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-methyl-5-thiazoleethanol,bmse000355,7273,1,,4-methyl-5-thiazoleethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Anisic_acid,bmse000356,7295,1,,p-Anisic_acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000357,7316,1,,pyrrole-2-carboxylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,chlorohydroquinone,bmse000358,7329,1,,chlorohydroquinone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000359,7350,1,,D-3-Phenyllactic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-chloroethanol,bmse000360,7363,1,,2-chloroethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,(R)-2-hydroxybutyric,bmse000361,7384,1,,(R)-2-hydroxybutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-butyn-1-ol,bmse000362,7406,1,,3-butyn-1-ol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Propargyl,bmse000363,7427,1,,Propargyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-hydroxyindole-3-acetic,bmse000364,7448,1,,5-hydroxyindole-3-acetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,arbutin,bmse000365,7471,1,,arbutin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000366,7492,1,,beta-carotene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Chloroacetic,bmse000367,7505,1,,Chloroacetic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cis-3-chloroacrylic,bmse000368,7526,1,,cis-3-chloroacrylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cis-3-hexen-1-ol,bmse000369,7548,1,,cis-3-hexen-1-ol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,decanoic-acid,bmse000370,7570,1,,decanoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,diethanolamine,bmse000371,7591,1,,diethanolamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,epsilon-caprolactam,bmse000372,7612,1,,epsilon-caprolactam,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,isovaleric-acid,bmse000373,7633,1,,isovaleric-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000374,7655,1,,lanosterol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-menthone,bmse000375,7668,1,,L-menthone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-carbamyl-L-glutamic,bmse000376,7690,1,,N-carbamyl-L-glutamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phenethylamine,bmse000377,7712,1,,Phenethylamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,suberic,bmse000378,7734,1,,suberic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,triethanolamine,bmse000379,7755,1,,triethanolamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-Cysteic,bmse000380,7776,1,,L-Cysteic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,(R)-(-)-Pantolactone,bmse000381,7798,1,,(R)-(-)-Pantolactone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-Acetyl-L-glutamic,bmse000382,7820,1,,N-Acetyl-L-glutamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Methyl-2-oxovaleric,bmse000383,7843,1,,4-Methyl-2-oxovaleric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Guanidineacetic,bmse000384,7865,1,,Guanidineacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pyrocatechol,bmse000385,7886,1,,Pyrocatechol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000386,7908,1,,Malonic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Chlorogenic,bmse000387,7921,1,,Chlorogenic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Cysteamine,bmse000388,7944,1,,Cysteamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Gallic,bmse000389,7965,1,,Gallic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL-2-Aminobutyric,bmse000390,7987,1,,DL-2-Aminobutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phthalic,bmse000391,8009,1,,Phthalic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acrylamide,bmse000392,8032,1,,Acrylamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000393,8053,1,,oxalomalic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,6-Aminohexanoic,bmse000394,8066,1,,6-Aminohexanoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Chlorophenylacetate,bmse000395,8088,1,,4-Chlorophenylacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha-((Methylamino)methyl)benzyl,bmse000396,8110,1,,alpha-((Methylamino)methyl)benzyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL-Methionine,bmse000397,8133,1,,DL-Methionine sulfoxide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methylmalonic,bmse000398,8155,1,,Methylmalonic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,O-Phospho-L-serine,bmse000399,8177,1,,O-Phospho-L-serine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ethanesulfonic,bmse000400,8199,1,,ethanesulfonic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000401,8220,1,,"DL-alpha,epsilon-Diaminopimelic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Butyric,bmse000402,8242,1,,Butyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ala-Ala,bmse000403,8263,1,,Ala-Ala,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,(-)-Norepinephrine,bmse000404,8286,1,,(-)-Norepinephrine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Cyclohexanone,bmse000405,8308,1,,Cyclohexanone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Glutaric,bmse000406,8329,1,,Glutaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Benzyl,bmse000407,8350,1,,Benzyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Hippuric,bmse000408,8372,1,,Hippuric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dl-Indole-3-lactic,bmse000409,8395,1,,dl-Indole-3-lactic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Kynurenic,bmse000410,8417,1,,Kynurenic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-Norleucine,bmse000411,8440,1,,L-Norleucine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dihydrocoumarin,bmse000412,8462,1,,Dihydrocoumarin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Tropic,bmse000413,8485,1,,Tropic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Toluic,bmse000414,8507,1,,p-Toluic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Resorcinol,bmse000415,8529,1,,Resorcinol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetylenedicarboxylic,bmse000416,8551,1,,Acetylenedicarboxylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,quinaldic,bmse000417,8569,1,,quinaldic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000418,8590,1,,Phosphonoacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-Aminovaleric-acid,bmse000419,8603,1,,5-Aminovaleric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Chlorocatechol,bmse000420,8619,1,,4-Chlorocatechol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-methylcytosine,bmse000421,8642,1,,5-methylcytosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Hydroxy-3-methoxycinnamaldehyde,bmse000422,8665,1,,4-Hydroxy-3-methoxycinnamaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-acetyl-L-aspartic,bmse000423,8688,1,,N-acetyl-L-aspartic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Adipic,bmse000424,8711,1,,Adipic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dihydrouracil,bmse000425,8732,1,,Dihydrouracil,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Trimethylamine,bmse000426,8753,1,,Trimethylamine N-oxide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phenylacetaldehyde,bmse000427,8774,1,,phenylacetaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,R-(-)-Citramalic,bmse000428,8789,1,,R-(-)-Citramalic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL-2-Aminoadipic,bmse000429,8810,1,,DL-2-Aminoadipic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL-homocysteine,bmse000430,8833,1,,DL-homocysteine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Cyclohexanol,bmse000431,8855,1,,Cyclohexanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pyridine,bmse000432,8877,1,,Pyridine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,o-Cresol,bmse000433,8899,1,,o-Cresol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetylcholine,bmse000434,8921,1,,Acetylcholine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Glutaconic,bmse000435,8942,1,,Glutaconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Guaiacol,bmse000436,8964,1,,Guaiacol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Allantoin,bmse000437,8986,1,,Allantoin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Chlorobenzoic,bmse000438,9008,1,,4-Chlorobenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Isobutyric,bmse000439,9031,1,,Isobutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D-Glucosaminic,bmse000440,9053,1,,D-Glucosaminic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Hydroxyphenylacetonitrile,bmse000441,9075,1,,4-Hydroxyphenylacetonitrile,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-homocitrulline,bmse000442,9097,1,,L-homocitrulline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-(Hydroxymethyl)uracil,bmse000443,9119,1,,5-(Hydroxymethyl)uracil,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-hydroxy-3-methoxybenzyl,bmse000444,9142,1,,4-hydroxy-3-methoxybenzyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D-Panthenol,bmse000445,9161,1,,D-Panthenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,propanol,bmse000446,9183,1,,propanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,butanol,bmse000447,9204,1,,butanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-Histidinol,bmse000448,9225,1,,L-Histidinol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1-Methyl-L-histidine,bmse000449,9248,1,,1-Methyl-L-histidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D-Methionine,bmse000450,9271,1,,D-Methionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Cyclohexylamine,bmse000451,9294,1,,Cyclohexylamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Hypotaurine,bmse000452,9316,1,,Hypotaurine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ureidosuccinic,bmse000453,9337,1,,Ureidosuccinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,purine,bmse000454,9359,1,,purine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Hydroxyphenylacetic,bmse000455,9381,1,,4-Hydroxyphenylacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-Hydroxy-L-tryptophan,bmse000457,9404,1,,5-Hydroxy-L-tryptophan,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Cresol,bmse000458,9427,1,,p-Cresol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ferulic,bmse000459,9450,1,,Ferulic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Maleamic,bmse000460,9473,1,,Maleamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Chlorophenol,bmse000461,9495,1,,4-Chlorophenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Aminophenol,bmse000462,9517,1,,4-Aminophenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trans-trans-Muconic,bmse000463,9539,1,,trans-trans-Muconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetyl-L-carnitine,bmse000464,9561,1,,Acetyl-L-carnitine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phthalaldehydic,bmse000465,9583,1,,Phthalaldehydic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL-beta-leucine,bmse000466,9605,1,,DL-beta-leucine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetaldehyde,bmse000467,9627,1,,Acetaldehyde oxime mixture of syn and anti,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Acetamidobutyric,bmse000468,9649,1,,4-Acetamidobutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000469,9670,1,,"cis-1,2-cyclohexanediol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,biuret,bmse000470,9692,1,,biuret,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Glyoxylic,bmse000471,9710,1,,Glyoxylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,17-alpha-hydroxyprogesterone,bmse000472,9732,1,,17-alpha-hydroxyprogesterone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-(2-hydroxyethyl)indole,bmse000473,9755,1,,3-(2-hydroxyethyl)indole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-methylcrotonaldehyde,bmse000474,9778,1,,3-methylcrotonaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-methylcatechol,bmse000475,9799,1,,4-methylcatechol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-pregnen-3-beta-ol-20-one,bmse000476,9822,1,,5-pregnen-3-beta-ol-20-one,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,beta-sitosterol,bmse000477,9845,1,,beta-sitosterol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000478,9866,1,,Lanosterol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-acetyl-D-Phenyl,bmse000479,9879,1,,N-acetyl-D-Phenyl alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Octane,bmse000480,9902,1,,Octane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phenyl-Acetate,bmse000481,9924,1,,Phenyl-Acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Progesterone,bmse000482,9946,1,,Progesterone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,R-(+)-2-Pyrrolidinone-5-carboxylate,bmse000483,9969,1,,R-(+)-2-Pyrrolidinone-5-carboxylate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,squalene,bmse000484,9991,1,,squalene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Stearic-Acid,bmse000485,10013,1,,Stearic-Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,vanillic,bmse000486,10034,1,,vanillic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1-Hexadecanol,bmse000487,10057,1,,1-Hexadecanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-indoleacetonitrile,bmse000488,10078,1,,3-indoleacetonitrile,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-alpha-cholestan-3-one,bmse000489,10101,1,,5-alpha-cholestan-3-one,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000490,10123,1,,"5-alpha-pregnane-3,20-dione(allo)",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha-pinene-oxide,bmse000491,10145,1,,alpha-pinene-oxide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse000492,10167,1,,(+)alpha-tocopherol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Epsilon-caprolactone,bmse000493,10182,1,,Epsilon-caprolactone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ergosterol,bmse000494,10203,1,,Ergosterol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Fenchol,bmse000495,10226,1,,Fenchol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Indanone,bmse000496,10248,1,,Indanone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Linoleic,bmse000497,10272,1,,Linoleic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000498,10295,1,,"(1S,2S,5R)-(+)-neomenthol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Nonanoic-Acid,bmse000499,10317,1,,Nonanoic-Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,(R)-(-)-Carvone,bmse000500,10339,1,,(R)-(-)-Carvone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Retinyl-palmitate,bmse000501,10362,1,,Retinyl-palmitate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Octanoic-Acid,bmse000502,10385,1,,Octanoic-Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-cymene,bmse000503,10406,1,,p-cymene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Terpinolene,bmse000504,10428,1,,Terpinolene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-isopropylbenzyl,bmse000505,10450,1,,4-isopropylbenzyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,biphenyl,bmse000506,10463,1,,biphenyl,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cholecalciferol,bmse000507,10485,1,,cholecalciferol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cuminaldehyde,bmse000508,10508,1,,cuminaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dodecanoic-acid,bmse000509,10530,1,,Dodecanoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ergocalciferol,bmse000510,10551,1,,ergocalciferol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,quinidine,bmse000511,10574,1,,quinidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cortexolone,bmse000512,10597,1,,cortexolone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000513,10620,1,,"1,4-cyclohexanedione",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Indanone,bmse000514,10641,1,,2-Indanone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-methylbenzyl-alcohol,bmse000515,10663,1,,2-methylbenzyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-methylindole,bmse000516,10685,1,,3-methylindole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000517,10707,1,,"4,4-dichlorobenzophenone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-chloroacetophenone,bmse000518,10730,1,,4-chloroacetophenone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,(+)-4-cholesten-3-one,bmse000519,10753,1,,(+)-4-cholesten-3-one,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-methylbenzyl-alcohol,bmse000520,10775,1,,4-methylbenzyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,9_fluorenone,bmse000521,10797,1,,9_fluorenone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adrenosterone,bmse000522,10820,1,,adrenosterone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,eucalyptol,bmse000523,10842,1,,eucalyptol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,fluorene,bmse000524,10865,1,,fluorene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,jasmonic-acid,bmse000525,10888,1,,jasmonic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,o-xylene,bmse000526,10910,1,,o-xylene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-tolualdehyde,bmse000527,10933,1,,p-tolualdehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,stigmasterol,bmse000528,10956,1,,stigmasterol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,11-alpha-hydroxyprogesterone,bmse000529,10978,1,,11-alpha-hydroxyprogesterone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000530,11000,1,,"1,2,3,4-tetrahydronaphthalene",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1-methylnaphthalene,bmse000531,11022,1,,1-methylnaphthalene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1-naphthaldehyde,bmse000532,11044,1,,1-naphthaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000533,11066,1,,"(1R,2R,4R)-dihydrocarveol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1R-myrtenal,bmse000534,11088,1,,(1R)-(-)-myrtenal,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,21-hydroxyprogesterone,bmse000535,11109,1,,21-hydroxyprogesterone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-hexenal,bmse000536,11131,1,,2-hexenal,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-methylnaphthalene,bmse000537,11153,1,,2-methylnaphthalene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-hydroxy-2-methyl-4-pyrone,bmse000538,11173,1,,3-hydroxy-2-methyl-4-pyrone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-isochromanone,bmse000539,11193,1,,3-isochromanone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-methylbenzyl-alcohol,bmse000540,11213,1,,3-methylbenzyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-alpha-cholestan-3-beta-ol,bmse000541,11236,1,,5-alpha-cholestan-3-beta-ol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha-lipoic-acid,bmse000542,11258,1,,alpha-lipoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,androsterone,bmse000543,11280,1,,androsterone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cholesteryl-palmitate,bmse000544,11303,1,,cholesteryl-palmitate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cyclohexane,bmse000545,11326,1,,cyclohexane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000546,11350,1,,Cyclohexanecarboxylic acid,non-polymer,,,,,,,,,,no,no,,,no,BMET000546,chem_comp_1,1,1,no,not present,,,,,,,128.16898,,,,,
entity,delta-tocopherol,bmse000547,11371,1,,delta-tocopherol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dibenzofuran,bmse000548,11393,1,,dibenzofuran,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,estrone,bmse000549,11415,1,,estrone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ethyl-heptanoate,bmse000550,11437,1,,ethyl-heptanoate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl-jasmonate,bmse000551,11458,1,,methyl-jasmonate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,m-tolualdehyde,bmse000552,11480,1,,m-tolualdehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,m-toluic-acid,bmse000553,11503,1,,m-toluic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,m-xylene,bmse000554,11526,1,,m-xylene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,myrtenol,bmse000555,11548,1,,myrtenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,o-tolualdehyde,bmse000556,11570,1,,o-tolualdehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,o-toluic-acid,bmse000557,11593,1,,o-toluic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,pentadecanoic-acid,bmse000558,11616,1,,pentadecanoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,(s)-(-)-perillyl-alcohol,bmse000559,11637,1,,(s)-(-)-perillyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phenanthrene,bmse000560,11659,1,,phenanthrene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,pinocarveol,bmse000561,11681,1,,pinocarveol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,retinoic-acid,bmse000562,11703,1,,retinoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,undecanoic-acid,bmse000563,11725,1,,undecanoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,9-hydroxyfluorene,bmse000564,11746,1,,9-hydroxyfluorene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cis-5-dodecenoic-acid,bmse000565,11768,1,,cis-5-dodecenoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glyceryl-tridecanoate,bmse000566,11790,1,,glyceryl-tridecanoate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,tetrabromobisphenol-A,bmse000567,11812,1,,tetrabromobisphenol-A,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000568,11835,1,,"1,2-dichloroethane",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000569,11856,1,,"1,6-anhydro-beta-d-glucose",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,(S)-(+)-2-hydroxy-3-methylbutyric-acid,bmse000570,11877,1,,(S)-(+)-2-hydroxy-3-methylbutyric-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-hydroxyhexanoic-acid,bmse000571,11898,1,,2-hydroxyhexanoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-hydroxyoctanoic-acid,bmse000572,11919,1,,2-hydroxyoctanoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-hydroxymandelic-acid,bmse000573,11941,1,,3-hydroxymandelic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-methyl-2-oxopentanoic-acid,bmse000574,11963,1,,3-methyl-2-oxopentanoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-methylglutaric-acid,bmse000575,11984,1,,3-methylglutaric-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetosyringone,bmse000576,12006,1,,acetosyringone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,(-)-cotinine,bmse000577,12029,1,,(-)-cotinine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ethylmalonic-acid,bmse000578,12051,1,,ethylmalonic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,monoethyl-malonate,bmse000579,12073,1,,monoethyl-malonate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,mono-methyl-glutarate,bmse000580,12095,1,,mono-methyl-glutarate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-methyl-2-butenoic-acid,bmse000581,12108,1,,3-methyl-2-butenoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Hydroxybenzaldehyde,bmse000582,12130,1,,4-Hydroxybenzaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Hydroxy-benzoic-acid,bmse000583,12153,1,,4-Hydroxy-benzoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetovanillone,bmse000584,12176,1,,acetovanillone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dihydroconiferyl-alcohol,bmse000585,12199,1,,dihydroconiferyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dihydro-sinapyl-alcohol,bmse000586,12222,1,,dihydro-sinapyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ferulic-acid,bmse000587,12245,1,,Ferulic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,gly-pro,bmse000588,12268,1,,gly-pro,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl-sinapate,bmse000589,12290,1,,methyl-sinapate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,palmitic-acid,bmse000590,12312,1,,palmitic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-coumaric-acid,bmse000591,12333,1,,p-coumaric-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-coumaryl-alcohol,bmse000592,12356,1,,p-coumaryl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-hydroxyacetophenone,bmse000593,12378,1,,p-hydroxyacetophenone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,sinapinic-acid,bmse000594,12401,1,,sinapinic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,syringaldehyde,bmse000595,12424,1,,syringaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trans-3-hexenedioic-acid,bmse000596,12447,1,,trans-3-hexenedioic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,vanillin,bmse000597,12469,1,,vanillin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,17-alpha-hydroxyprogesterone,bmse000598,12492,1,,17-alpha-hydroxyprogesterone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Nonadecane,bmse000764,15942,1,,Nonadecane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-isopropylbenzyl-alcohol,bmse000599,12515,1,,4-isopropylbenzyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,(+)alpha-tocopherol,bmse000600,12536,1,,(+)alpha-tocopherol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,coniferaldehyde,bmse000601,12557,1,,coniferaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,coniferyl-alcohol,bmse000602,12580,1,,coniferyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cyclohexanecarboxylic-acid,bmse000603,12603,1,,cyclohexanecarboxylic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Linoleic-Acid,bmse000604,12624,1,,Linoleic-Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl-4-coumarate,bmse000605,12646,1,,methyl-4-coumarate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,sinapaldehyde,bmse000606,12669,1,,sinapaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,syringic-acid,bmse000607,12692,1,,syringic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,coniferin,bmse000608,12715,1,,coniferin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl-ferulate,bmse000609,12736,1,,methyl-ferulate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,n-acetylglycine,bmse000610,12758,1,,n-acetylglycine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-coumaraldehyde,bmse000611,12778,1,,p-coumaraldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,sinapyl-alcohol,bmse000612,12800,1,,sinapyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,syringin,bmse000613,12821,1,,syringin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,vanillic-acid,bmse000614,12842,1,,vanillic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-furoylglycine,bmse000615,12864,1,,2-furoylglycine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-octenoic-acid,bmse000616,12886,1,,2-octenoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-phenylbutyric-acid,bmse000617,12909,1,,2-phenylbutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-hydroxy-4-methoxycinnamic-acid,bmse000618,12931,1,,3-hydroxy-4-methoxycinnamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-methyladipic-acid,bmse000619,12954,1,,3-methyladipic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-methylsalicylic-acid,bmse000620,12977,1,,3-methylsalicylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-pyridine-aldoxime,bmse000621,13000,1,,3-pyridine aldoxime,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-pyridinecarbonitrile,bmse000622,13022,1,,3-pyridinecarbonitrile,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-hydroxybenzyl-alcohol,bmse000623,13044,1,,4-hydroxybenzyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-methylsalicylic-acid,bmse000624,13066,1,,4-methylsalicylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-methylvaleric-acid,bmse000625,13089,1,,4-methylvaleric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5_methoxytryptamine,bmse000626,13112,1,,5_methoxytryptamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,bilirubin,bmse000627,13135,1,,bilirubin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cis-fenpropimorph,bmse000628,13158,1,,cis-fenpropimorph,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-4-hydroxyphenylglycine,bmse000629,13181,1,,L-4-hydroxyphenylglycine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-cyclohexylformamide,bmse000630,13204,1,,N-cyclohexylformamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,O-phospho-DL-threonine,bmse000631,13227,1,,O-phospho-DL-threonine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,sulfoacetic-acid,bmse000632,13249,1,,sulfoacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,tetrachloroethylene,bmse000633,13270,1,,tetrachloroethylene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000634,13287,1,,"4,4-DDT",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-chlorophenoxyacetic-acid,bmse000635,13308,1,,4-chlorophenoxyacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phenylacetylglycine,bmse000636,13321,1,,phenylacetylglycine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phosphonoacetic-acid,bmse000637,13334,1,,phosphonoacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-perillaldehyde,bmse000638,13347,1,,(S)-(-)-perillaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1-methylnicotinamide,bmse000639,13369,1,,1-methylnicotinamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000640,13391,1,,"2,4,5-trichlorophenoxyacetic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-ureidopropionic-acid,bmse000641,13413,1,,3-ureidopropionic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,beta-Estradiol,bmse000642,13435,1,,beta-Estradiol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,elaidic-acid,bmse000643,13457,1,,elaidic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycodesoxycholic-acid,bmse000644,13479,1,,glycodesoxycholic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,indole-3-carboxaldehyde,bmse000645,13501,1,,indole-3-carboxaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,indole-3-pyruvic-acid,bmse000646,13524,1,,indole-3-pyruvic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,metaldehyde,bmse000647,13546,1,,metaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,rosmarinic-acid,bmse000648,13567,1,,rosmarinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,atropine,bmse000649,13589,1,,atropine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cholic-acid,bmse000650,13611,1,,cholic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycocholic-acid,bmse000651,13633,1,,glycocholic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lactulose,bmse000652,13656,1,,lactulose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000653,13678,1,,"O,O-diethyl thiophosphate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_serine,bmse000885,17900,1,,L-serine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-methylglutaric-acid,bmse000654,13699,1,,2-methylglutaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,"cis-1,2-dihydronaphthalene-1,2-diol",bmse000655,13722,1,,"cis-1,2-dihydronaphthalene-1,2-diol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cyanamide,bmse000656,13745,1,,cyanamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-cyclohexylsulfamic-acid,bmse000657,13763,1,,N-cyclohexylsulfamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phenylacetylglycine,bmse000658,13785,1,,phenylacetylglycine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-phenylethanol,bmse000659,13808,1,,2-phenylethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phosphonoacetic-acid,bmse000660,13830,1,,phosphonoacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000661,13851,1,,"2,5-dichlorohydroquinone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-isopropylbenzoic-acid,bmse000662,13873,1,,4-isopropylbenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cortisone,bmse000663,13896,1,,cortisone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,erythromycin,bmse000664,13919,1,,erythromycin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trans_dehydroandrosterone,bmse000665,13940,1,,trans_dehydroandrosterone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,carbazole,bmse000666,13961,1,,carbazole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_terpineol,bmse000667,13982,1,,alpha_terpineol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,benzamide,bmse000668,14003,1,,benzamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,corticosterone,bmse000669,14024,1,,corticosterone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-hydroxyacetophenone,bmse000670,14046,1,,p-hydroxyacetophenone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_2_bis4_chlorophenylethanol,bmse000671,14067,1,,2_2_bis(4_chlorophenyl)ethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_4_dichlorobenzoic_acid,bmse000672,14089,1,,2_4_dichlorobenzoic_acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_5_dichlorophenol,bmse000673,14110,1,,2_5_dichlorophenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_6_dichlorophenol,bmse000674,14132,1,,2_6_dichlorophenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,hydrocinnamic_acid,bmse000675,14153,1,,hydrocinnamic_acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,nitrobenzene,bmse000676,14174,1,,nitrobenzene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,salicylaldehyde,bmse000677,14195,1,,salicylaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000678,14216,1,,"2,4,6-trichlorophenol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-naphthaldehyde,bmse000679,14237,1,,2-naphthaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000680,14258,1,,"3,4-dihydroxyhydrocinnamate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-ethylphenol,bmse000681,14280,1,,4-ethylphenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,homoveratric-acid,bmse000682,14302,1,,homoveratric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-naphthalenemethanol,bmse000683,14323,1,,2-naphthalenemethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000684,14345,1,,"DL-3,4-dihydroxymandelic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,indole-3-pyruvic-acid,bmse000685,14366,1,,indole-3-pyruvic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lithocholic-acid,bmse000686,14386,1,,lithocholic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-3-indolylacetyl-L-alanine,bmse000687,14407,1,,N-(3-indolylacetyl)-L-alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000688,14428,1,,"1,4-dihydroxy-2-naphthanoic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1-hydroxy-2-naphthoic-acid,bmse000689,14448,1,,1-hydroxy-2-naphthoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1_naphthalenemethanol,bmse000690,14469,1,,1_naphthalenemethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000691,14489,1,,"2,4-dichlorophenol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-amino-3-methoxybenzoic-acid,bmse000692,14509,1,,2-amino-3-methoxybenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-naphthoic-acid,bmse000693,14529,1,,2-naphthoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-methoxy-3-indoleacetic-acid,bmse000694,14549,1,,5-methoxy-3-indoleacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,benzylsuccinic-acid,bmse000695,14570,1,,benzylsuccinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,indole-3-acetamide,bmse000696,14592,1,,indole-3-acetamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,pentachlorophenol,bmse000697,14613,1,,pentachlorophenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-perillic-acid,bmse000698,14630,1,,(S)-(-)-perillic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,thiamine-monophosphate,bmse000699,14652,1,,thiamine monophosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,16-hydroxyhexadecanoic-acid,bmse000700,14674,1,,16-hydroxyhexadecanoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-phenylbutyric-acid,bmse000701,14694,1,,4-phenylbutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,hyodeoxycholic-acid,bmse000702,14716,1,,hyodeoxycholic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-hydroxy-3-methoxymandelic-acid,bmse000703,14737,1,,4-hydroxy-3-methoxymandelic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,chalcone,bmse000704,14758,1,,chalcone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cis-aconitic-acid,bmse000705,14779,1,,cis-aconitic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-cysteinesulfinic-acid,bmse000706,14800,1,,L-cysteinesulfinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-acetyl-histidine,bmse000707,14821,1,,N-acetyl-histidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,nicotinuric-acid,bmse000708,14842,1,,nicotinuric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000709,14863,1,,"N,N-dimethylformamide",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,O-acetyl-L-serine,bmse000710,14883,1,,O-acetyl-L-serine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-Arginine,bmse000711,14895,1,,L-Arginine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000712,14915,1,,"2,3-dideoxycytidine",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-amino-3-phosphonopropionic-acid,bmse000713,14935,1,,2-amino-3-phosphonopropionic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-ethylpiperidine,bmse000714,14955,1,,2-ethylpiperidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-hydroxyphenylacetic-acid,bmse000715,14975,1,,2-hydroxyphenylacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,8-anilino-1-naphthalenesulfonic-acid,bmse000716,14995,1,,8-anilino-1-naphthalenesulfonic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cetyl-trimethyl-ammonium,bmse000717,15014,1,,cetyl-trimethyl-ammonium,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000718,15032,1,,"cis-1,3-dichloropropene",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,decamethonium,bmse000719,15052,1,,decamethonium,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dioctyl-sulfosuccinate,bmse000720,15071,1,,dioctyl sulfosuccinate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,diphenylacetic-acid,bmse000721,15092,1,,diphenylacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,epichlorohydrin,bmse000722,15113,1,,epichlorohydrin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-2-furoylglycine-methyl-ester,bmse000723,15134,1,,N-(2-furoyl)glycine methyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,o-fluoroaniline,bmse000724,15155,1,,o-fluoroaniline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,sec-butylbenzene,bmse000725,15176,1,,sec-butylbenzene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,sulfanilic-acid,bmse000726,15197,1,,sulfanilic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000727,15218,1,,"trans-2,3-dimethylacrylic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1-amino-1-cyclohexanecarboxylic-acid,bmse000728,15239,1,,1-amino-1-cyclohexanecarboxylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000729,15259,1,,"2,3-difluorobenzyl alcohol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000730,15280,1,,"2,2-dimethylsuccinic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-deazauridine,bmse000731,15300,1,,3-deazauridine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,6-ethylmercaptopurine,bmse000732,15321,1,,6-ethylmercaptopurine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,apocholic-acid,bmse000733,15343,1,,apocholic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,bis2-butoxyethylphthalate,bmse000734,15364,1,,bis(2-butoxyethyl)phthalate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,digoxigenin,bmse000735,15385,1,,digoxigenin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-methylphenylacetate,bmse000736,15407,1,,3-methylphenylacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,myristic-acid,bmse000737,15421,1,,myristic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-methylurea,bmse000738,15441,1,,N-methylurea,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-fluorobenzoic-acid,bmse000739,15460,1,,p-fluorobenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D-pinitol,bmse000740,15480,1,,D-pinitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-methyl-L-aspartic-acid,bmse000741,15502,1,,N-methyl-L-aspartic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phenoxyacetic-acid,bmse000742,15523,1,,phenoxyacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phenylglyoxylic-acid,bmse000743,15544,1,,phenylglyoxylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Histamine,bmse000744,15566,1,,Histamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Homoarginine,bmse000745,15586,1,,Homoarginine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Mesaconic-acid,bmse000746,15606,1,,Mesaconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Metrizamide,bmse000747,15626,1,,Metrizamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Parabanic-acid,bmse000748,15638,1,,Parabanic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,21-Hydroxypregnenolone,bmse000749,15654,1,,21-Hydroxypregnenolone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Hydroxyethyl-salicylate,bmse000750,15674,1,,2-Hydroxyethyl salicylate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,khellin,bmse000751,15694,1,,khellin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phenylmethanesulfonyl-fluoride,bmse000752,15715,1,,Phenylmethanesulfonyl fluoride,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Polyoxyethylene-23-lauryl-ether,bmse000753,15735,1,,Polyoxyethylene 23 lauryl ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Precocene-1,bmse000754,15753,1,,Precocene 1,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Procyclidine,bmse000755,15774,1,,Procyclidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Nitrofluoranthene,bmse000756,15794,1,,3-Nitrofluoranthene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,serotonin,bmse000757,15814,1,,serotonin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-Methoxypsoralen,bmse000758,15835,1,,5-Methoxypsoralen,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-methyluridine,bmse000759,15856,1,,5-methyluridine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Homoarginine,bmse000760,15877,1,,Homoarginine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Mesaconic-acid,bmse000761,15889,1,,Mesaconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,neostigmine,bmse000762,15900,1,,neostigmine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,octamethylcyclotetrasiloxane,bmse000765,15961,1,,octamethylcyclotetrasiloxane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,orthanilic-acid,bmse000766,15980,1,,orthanilic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Propiolic-acid,bmse000767,16000,1,,Propiolic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,saligenin,bmse000768,16011,1,,saligenin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha-Lipoamide,bmse000769,16032,1,,alpha-Lipoamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phenyl-beta-D-glucoside,bmse000770,16051,1,,Phenyl beta-D-glucoside,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pyromellitic-acid,bmse000771,16070,1,,Pyromellitic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Salicylhydroxamic-Acid,bmse000772,16089,1,,Salicylhydroxamic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,triethylenetetramine,bmse000773,16108,1,,triethylenetetramine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Trimethyl-Phosphate,bmse000774,16126,1,,Trimethyl Phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Methoxybenzamide,bmse000775,16144,1,,3-Methoxybenzamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-Anserine,bmse000776,16164,1,,L-Anserine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Tributyl-Phosphate,bmse000777,16185,1,,Tributyl Phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,gamma-terpinene,bmse000778,16204,1,,gamma-terpinene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Metoclopramide,bmse000779,16224,1,,Metoclopramide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Tetramethylammonium-,bmse000780,16243,1,,Tetramethylammonium,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,thioacetamide,bmse000781,16261,1,,thioacetamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cacodylic-acid,bmse000786,16279,1,,cacodylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,MES,bmse000787,16300,1,,MES,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,MOPS,bmse000788,16321,1,,MOPS,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,creatinine,bmse000789,16342,1,,Creatinine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,imidazole,bmse000790,16359,1,,imidazole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucose,bmse000791,16376,1,,D-(+)-Glucose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,HEPES,bmse000792,16393,1,,HEPES,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000793,16408,1,,"1,4-D-xylobiose",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-carboxypropyl-trimethyl-ammonium,bmse000794,16427,1,,3-carboxypropyl-trimethyl-ammonium,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DSS,bmse000795,16445,1,,DSS,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1_3_diaminopropane,bmse000796,16463,1,,1-3-diaminopropane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucose,bmse000797,16477,1,,D-(+)-Glucose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_maltose,bmse000798,16491,1,,D-(+)-maltose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_psicose,bmse000799,16505,1,,D-Psicose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_citrulline,bmse000800,16519,1,,L-citrulline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_ketoglutaric_acid,bmse000801,16533,1,,alpha-ketoglutaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arabitol,bmse000802,16547,1,,L-(-) arabitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_sorbitol,bmse000803,16561,1,,D-sorbitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,sucrose,bmse000804,16575,1,,sucrose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,taurine,bmse000805,16589,1,,taurine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutathione_oxidized,bmse000806,16603,1,,"L(-)-Glutathione, oxidized",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycerol,bmse000807,16617,1,,Glycerol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_allose,bmse000808,16631,1,,D-allose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_serine,bmse000809,16645,1,,L-serine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_threonine,bmse000810,16659,1,,L-threonine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_valine,bmse000811,16673,1,,L-valine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,agmatine,bmse000812,16687,1,,agmatine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lactose,bmse000813,16701,1,,Lactose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,putrescine,bmse000814,16715,1,,"putrescine (1,4 diaminobutane)",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_trehalose,bmse000815,16729,1,,D-Trehalose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,uridine,bmse000816,16743,1,,Uridine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetic_acid,bmse000817,16757,1,,Acetic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_lactic_acid,bmse000818,16771,1,,L-(+) lactic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,isethionic_acid,bmse000819,16785,1,,Isethionic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,gamma-Aminobutyric,bmse000820,16799,1,,gamma-Aminobutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,R-(+)-2-Pyrrolidinone-5-carboxylate,bmse000821,16813,1,,R-(+)-2-Pyrrolidinone-5-carboxylate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cacodylic-acid,bmse000822,16827,1,,cacodylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000823,16841,1,,"1,4-D-xylobiose",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Deoxyguanosine-5-monophosphate,bmse000824,16855,1,,2'-Deoxyguanosine 5'-monophosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetamide,bmse000825,16881,1,,acetamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetonitrile,bmse000826,16899,1,,acetonitrile,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL-2-Aminocaprylic-acid,bmse000827,16917,1,,DL-2-Aminocaprylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL-3-Aminoisobutyric-acid,bmse000828,16936,1,,DL-3-Aminoisobutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,IPTG,bmse000829,16955,1,,IPTG,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-alpha-Acetyl-L-lysine,bmse000830,16975,1,,N-alpha-Acetyl-L-lysine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000831,16995,1,,"1,2,4-Benzenetriol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,beta-carotene,bmse000832,17015,1,,beta-carotene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,deoxycholic-acid,bmse000833,17034,1,,deoxycholic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-xylene,bmse000834,17055,1,,p-xylene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-chloro-4-ethylamino-6-isopropylamino-S-triazine,bmse000835,17074,1,,2-chloro-4-ethylamino-6-isopropylamino-S-triazine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Iodoquinol,bmse000836,17096,1,,Iodoquinol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000837,17113,1,,"cis-1,2-Cyclohexanediol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N-3-Indolylacetyl-DL-aspartic-acid,bmse000838,17132,1,,N-(3-Indolylacetyl)-DL-aspartic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,temporary,bmse000839,17152,1,,(+)-Pulegone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,rhodanine,bmse000840,17174,1,,rhodanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000841,17192,1,,"1,2,4-Trichlorobenzene",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Furoic-acid,bmse000842,17211,1,,3-Furoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Methylsalicylaldehyde,bmse000843,17230,1,,3-Methylsalicylaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Isoprene,bmse000844,17250,1,,Isoprene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000845,17270,1,,"4,4'-DDD",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phthalic-acid-diethyl-ester,bmse000846,17290,1,,Phthalic acid diethyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,undecanedioic-acid,bmse000847,17312,1,,undecanedioic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Thiophenecarboxylic-acid,bmse000848,17330,1,,2-Thiophenecarboxylic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Cholesteryl-stearate,bmse000849,17348,1,,Cholesteryl stearate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D-Sphingosine,bmse000850,17368,1,,D-Sphingosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,octanal,bmse000851,17387,1,,octanal,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Petroselinic-acid,bmse000852,17406,1,,Petroselinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Protoveratrine,bmse000853,17426,1,,Protoveratrine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ATP,bmse000854,17441,1,,ATP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucose,bmse000855,17456,1,,D-(+)-Glucose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycerol,bmse000856,17471,1,,Glycerol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetic_acid,bmse000857,17486,1,,Acetic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_citrulline,bmse000858,17501,1,,L-citrulline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_threonine,bmse000859,17516,1,,L-threonine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_valine,bmse000860,17531,1,,L-valine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adenine,bmse000861,17546,1,,adenine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,putrescine,bmse000862,17562,1,,"putrescine (1,4 diaminobutane)",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,taurine,bmse000863,17577,1,,taurine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,uridine,bmse000864,17591,1,,Uridine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_tagatose,bmse000865,17606,1,,D-(-)-Tagatose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_isoleucine,bmse000866,17621,1,,L-isoleucine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_serine,bmse000867,17636,1,,L-serine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_tryptophan,bmse000868,17651,1,,L-tryptophan,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arabitol,bmse000869,17666,1,,L-(-) arabitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,tyramine,bmse000870,17681,1,,Tyramine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,gamma-Aminobutyric,bmse000871,17696,1,,gamma-Aminobutyric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1_3_diaminopropane,bmse000872,17711,1,,1-3-diaminopropane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,AMP,bmse000873,17726,1,,AMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_mannose,bmse000874,17740,1,,D-(+)-Mannose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_aspartic_acid,bmse000875,17754,1,,L-aspartic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_trehalose,bmse000876,17769,1,,D-Trehalose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,HEPES,bmse000877,17784,1,,HEPES,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,R-(+)-2-Pyrrolidinone-5-carboxylate,bmse000878,17799,1,,R-(+)-2-Pyrrolidinone-5-carboxylate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Deoxyguanosine-5-monophosphate,bmse000879,17814,1,,2'-Deoxyguanosine 5'-monophosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,undecanedioic-acid,bmse000880,17830,1,,undecanedioic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse000881,17844,1,,"5,6-Dimethylbenzimidazole",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_mannose,bmse000882,17858,1,,D-(+)-Mannose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_tagatose,bmse000883,17872,1,,D-(-)-Tagatose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_isoleucine,bmse000884,17886,1,,L-isoleucine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adonitol,bmse000886,17914,1,,adonitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_aminobenzoic_acid,bmse000887,17928,1,,4-aminobenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,inosine,bmse000888,17942,1,,inosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_cellobiose,bmse000889,17956,1,,D-cellobiose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,HEPES,bmse000890,17970,1,,HEPES,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,tyramine,bmse000891,17984,1,,Tyramine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,MES,bmse000892,17998,1,,MES,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,MOPS,bmse000893,18012,1,,MOPS,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-carboxypropyl-trimethyl-ammonium,bmse000894,18026,1,,3-carboxypropyl-trimethyl-ammonium,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetamide,bmse000895,18040,1,,acetamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetonitrile,bmse000896,18054,1,,acetonitrile,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_ornithine,bmse000897,18068,1,,D-ornithine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_xylose,bmse000898,18083,1,,D-(+)-xylose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arginine,bmse000899,18098,1,,L-arginine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_phenylalanine,bmse000900,18112,1,,L-phenylalanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,myo_inositol,bmse000901,18126,1,,myo-inositol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_fructose,bmse000902,18140,1,,D-(-)-Fructose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_sorbose,bmse000903,18154,1,,D-(+)-Sorbose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,malic_acid,bmse000904,18169,1,,malic_acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3_hydroxybutyrate,bmse000905,18183,1,,3-hydroxybutyrate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutathione_oxidized,bmse000906,18198,1,,"L(-)-Glutathione, oxidized",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,6-Chloropurine-riboside,bmse000907,18213,1,,6-Chloropurine riboside,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Chenodeoxycholic-acid,bmse000908,18228,1,,Chenodeoxycholic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dopamine,bmse000909,18248,1,,Dopamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-alpha-Mannobiose,bmse000910,18267,1,,2-alpha-Mannobiose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,tetrahydrobiopterin,bmse000911,18286,1,,tetrahydrobiopterin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_asparagine,bmse000912,18305,1,,L-asparagine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutamic_acid,bmse000913,18319,1,,L-glutamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_lysine,bmse000914,18333,1,,L-lysine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_methionine,bmse000915,18347,1,,L-methionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_aminobenzoic_acid,bmse000916,18361,1,,4-aminobenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,anthranilic_acid,bmse000917,18375,1,,anthranilic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,sucrose,bmse000918,18389,1,,sucrose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arginine,bmse000919,18403,1,,L-arginine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_leucine,bmse000920,18417,1,,L-leucine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_phenylalanine,bmse000921,18431,1,,L-phenylalanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,myo_inositol,bmse000922,18445,1,,myo-inositol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-Thyroxine,bmse000923,18459,1,,L-Thyroxine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Miconazole,bmse000924,18479,1,,Miconazole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,nitrosobenzene,bmse000925,18499,1,,nitrosobenzene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Palmitoleic-acid,bmse000926,18518,1,,Palmitoleic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Taurocholic-acid,bmse000927,18537,1,,Taurocholic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,thiram,bmse000928,18556,1,,thiram,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Methoxytyramine,bmse000929,18574,1,,3-Methoxytyramine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Pyridoxic-acid,bmse000930,18593,1,,4-Pyridoxic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Argininosuccinic-acid,bmse000931,18613,1,,Argininosuccinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Phosphono-DL-alanine,bmse000932,18632,1,,3-Phosphono-DL-alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dopamine,bmse000933,18651,1,,dopamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_3_diphospho_D_glyceric_acid,bmse000934,18672,1,,"2,3-diphospho-D-glyceric acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ADP,bmse000935,18687,1,,ADP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,agmatine,bmse000936,18701,1,,agmatine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_ketoglutaric_acid,bmse000937,18716,1,,alpha-ketoglutaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lactose,bmse000938,18731,1,,Lactose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_cellobiose,bmse000939,18746,1,,D-cellobiose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,uracil,bmse000940,18761,1,,Uracil,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Boric-acid,bmse000941,18776,1,,Boric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Deoxyinosine,bmse000942,18789,1,,2'-Deoxyinosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-Methoxy-DL-tryptophan,bmse000943,18809,1,,5-Methoxy-DL-tryptophan,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ethyl-acetoacetate,bmse000944,18828,1,,Ethyl acetoacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Flavone,bmse000945,18847,1,,Flavone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_maltose,bmse000946,18866,1,,D-(+)-maltose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_proline,bmse000947,18881,1,,L-proline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,betaine,bmse000948,18896,1,,betaine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_carnitine,bmse000949,18911,1,,D-Carnitine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,creatine,bmse000950,18926,1,,creatine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,spermidine,bmse000951,18941,1,,spermidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutathione_reduced,bmse000952,18956,1,,L-Glutathione reduced,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Choline,bmse000953,18971,1,,Choline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_3_diphospho_D_glyceric_acid,bmse000954,18986,1,,"2,3-diphospho-D-glyceric acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,spermidine,bmse000955,19000,1,,spermidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutathione_reduced,bmse000956,19014,1,,L-Glutathione reduced,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-Aminovaleric-acid,bmse000957,19028,1,,5-Aminovaleric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Methoxytyramine,bmse000958,19042,1,,3-Methoxytyramine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Argininosuccinic-acid,bmse000959,19056,1,,Argininosuccinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Acetylphenylboronic-acid,bmse000960,19070,1,,3-Acetylphenylboronic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cholesteryl-sulfate,bmse000961,19089,1,,cholesteryl sulfate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Gentisaldehyde,bmse000962,19109,1,,Gentisaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,temporary,bmse000963,19129,1,,(+)-Limonene oxide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ocimene,bmse000964,19148,1,,Ocimene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_psicose,bmse000965,19167,1,,D-Psicose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,trans_4_hydroxy_L_proline,bmse000966,19182,1,,trans 4 hydroxy l proline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,beta_alanine,bmse000967,19197,1,,beta-alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,succinic_acid,bmse000968,19212,1,,Succinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cytidine,bmse000969,19226,1,,Cytidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1-Octanol,bmse000970,19241,1,,1-Octanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Morpholinopropylamine,bmse000971,19262,1,,3-Morpholinopropylamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Butyraldehyde,bmse000972,19282,1,,Butyraldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ethyl-4-aminobutyrate,bmse000973,19303,1,,Ethyl 4-aminobutyrate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Tropine,bmse000974,19323,1,,Tropine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_cysteine,bmse000975,19345,1,,L-cysteine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_histidine,bmse000976,19360,1,,L-histidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycine,bmse000977,19374,1,,glycine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,inosine,bmse000978,19389,1,,inosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_lactic_acid,bmse000979,19404,1,,L-(+) lactic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1-Octanol,bmse000980,19419,1,,1-Octanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Morpholinopropylamine,bmse000981,19433,1,,3-Morpholinopropylamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Isopropylmalic-acid,bmse000982,19448,1,,2-Isopropylmalic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,O-Acetyl-L-serine,bmse000983,19468,1,,O-Acetyl-L-serine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Amino-6-chloropurine,bmse000984,19487,1,,2-Amino-6-chloropurine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,6-Hydroxyflavanone,bmse000985,19507,1,,6-Hydroxyflavanone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Esculetin,bmse000986,19526,1,,Esculetin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Fludrocortisone,bmse000987,19541,1,,Fludrocortisone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Harmalol,bmse000988,19556,1,,Harmalol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lapachol,bmse000989,19575,1,,lapachol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5-Aminovaleric-acid,bmse000990,19595,1,,5-Aminovaleric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ADP,bmse000991,19610,1,,ADP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,AMP,bmse000992,19624,1,,AMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ATP,bmse000993,19638,1,,ATP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_alanine,bmse000994,19652,1,,L-alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adenine,bmse000995,19666,1,,adenine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adenosine,bmse000996,19680,1,,adenosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,betaine,bmse000997,19694,1,,betaine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,chorismic_acid,bmse000998,19708,1,,chorismic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,creatine,bmse000999,19722,1,,creatine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_L_glutamine,bmse001000,19736,1,,N-acetyl-L-Glutamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,creatinine,bmse001001,19750,1,,Creatinine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_carnosine,bmse001002,19764,1,,L-carnosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Choline,bmse001003,19778,1,,Choline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-Anserine,bmse001004,19792,1,,L-Anserine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_fructose,bmse001005,19806,1,,D-(-)-Fructose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_galactose,bmse001006,19821,1,,D-(+)-Galactose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_sorbitol,bmse001007,19836,1,,D-sorbitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_allose,bmse001008,19851,1,,D-allose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Fludrocortisone,bmse001009,19866,1,,Fludrocortisone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Harmalol,bmse001010,19880,1,,Harmalol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,EGTA,bmse001011,19894,1,,Boric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_fructose,bmse001012,19907,1,,D-(-)-Fructose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutamic_acid,bmse001013,19921,1,,L-glutamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutamine,bmse001014,19935,1,,L-glutamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_histidine,bmse001015,19949,1,,L-histidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_phenylalanine,bmse001016,19963,1,,L-phenylalanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_tryptophan,bmse001017,19977,1,,L-tryptophan,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,guanosine,bmse001018,19991,1,,guanosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,beta_alanine,bmse001019,20005,1,,beta-alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cytidine,bmse001020,20019,1,,Cytidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,11-Ketoetiocholanolone,bmse001021,20033,1,,11-Ketoetiocholanolone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3-Deazauridine,bmse001022,20048,1,,3-Deazauridine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D-+-Glucuronic-acid-G-lactone,bmse001023,20063,1,,D-(+)-Glucuronic acid G-lactone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UDP-Galactose,bmse001024,20078,1,,UDP Galactose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2-Isopropylmalic-acid,bmse001025,20093,1,,2-Isopropylmalic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-alpha-Lysophosphatidylcholine,bmse001026,20107,1,,L-alpha-Lysophosphatidylcholine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-alpha-Phosphatidylcholine,bmse001027,20120,1,,L-alpha-Phosphatidylcholine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-alpha-Phosphatidyl-DL-glycerol,bmse001028,20133,1,,L-alpha-Phosphatidyl-DL-glycerol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-chlorobenzaldehyde,bmse001029,20148,1,,4-chlorobenzaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,chlorobenzene,bmse001030,20161,1,,chlorobenzene,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse001031,20174,1,,"2,3-dihydro-2-oxofuran-5-acetate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,11-Ketoetiocholanolone,bmse001032,20188,1,,11-Ketoetiocholanolone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse001100,20203,1,,"2-methyl-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001100,,,,no,not present,,,,,,,142.1558,,,,,
entity,entity_1,bmse001101,20224,1,,Isovelleral,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001101,,,,no,not present,,,,,,,232.3181,,,,,
entity,entity_1,bmse001102,20245,1,,(Z)-octadec-11-enoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001102,,,,no,not present,,,,,,,282.46136,,,,,
entity,entity_1,bmse001103,20266,1,,"5,7-dihydroxy-2-phenylchromen-4-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001103,,,,no,not present,,,,,,,254.2375,,,,,
entity,entity_1,bmse001104,20287,1,,PENTYL BENZOATE,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001104,,,,no,not present,,,,,,,192.25424,,,,,
entity,entity_1,bmse001105,20308,1,,tetraoleoylcardiolipin,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001105,,,,no,not present,,,,,,,1457.995022,,,,,
entity,entity_1,bmse001106,20329,1,,"5,10,15,20-Tetraphenyl-21H,23H-porphine zinc",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001106,,,,no,not present,,,,,,,678.099919999999,,,,,
entity,entity_1,bmse001107,20350,1,,L-alpha-phosphatidylinositol,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001107,,,,no,not present,,,,,,,834.045380999998,,,,,
entity,entity_1,bmse001108,20371,1,,Nonanal,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001108,,,,no,not present,,,,,,,142.23862,,,,,
entity,entity_1,bmse001109,20392,1,,Sphingomyelin,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001109,,,,no,not present,,,,,,,703.028120999997,,,,,
entity,entity_1,bmse001110,20413,1,,Sodium glycochenodeoxycholate,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001110,,,,no,not present,,,,,,,471.60515,,,,,
entity,entity_1,bmse001111,20434,1,,"4a,5-dimethyl-3-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1H-naphthalene",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001111,,,,no,not present,,,,,,,204.35106,,,,,
entity,entity_1,bmse001112,20455,1,,1-Kestose,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001112,,,,no,not present,,,,,,,504.43708,,,,,
entity,entity_1,bmse001113,20476,1,,"8a-(hydroxymethyl)-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001113,,,,no,not present,,,,,,,442.716800000001,,,,,
entity,entity_1,bmse001114,20497,1,,3-(1H-indol-3-yl)prop-2-enoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001114,,,,no,not present,,,,,,,187.19466,,,,,
entity,entity_1,bmse001115,20517,1,,"2-[2,3-di(hexanoyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001115,,,,no,not present,,,,,,,454.515201000001,,,,,
entity,entity_1,bmse001116,20538,1,,"16:0 Biotinyl PE,1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine-N-(biotinyl) (sodium salt)",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001116,,,,no,not present,,,,,,,940.236310999997,,,,,
entity,entity_1,bmse001117,20559,1,,"16:0 Succinyl PE 1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine-N-(succinyl) (sodium salt)",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001117,,,,no,not present,,,,,,,814.013710999998,,,,,
entity,entity_1,bmse001118,20580,1,,"sodium (10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl) sulfate",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001118,,,,no,not present,,,,,,,392.48533,,,,,
entity,entity_1,bmse001119,20601,1,,[(2R)-3-hexadecanoyloxy-2-[(Z)-octadec-9-enoyl]oxypropyl] 2-trimethylazaniumylethyl phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001119,,,,no,not present,,,,,,,760.076140999997,,,,,
entity,entity_1,bmse001120,20622,1,,"methyl (10E,12Z)-octadeca-10,12-dienoate",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001120,,,,no,not present,,,,,,,294.472060000001,,,,,
entity,entity_1,bmse001121,20643,1,,"5,7-Dihydroxy-2-(4-hydroxyphenyl)chroman-4-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001121,,,,no,not present,,,,,,,272.25278,,,,,
entity,entity_1,bmse001122,20664,1,,"3-(4-Hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001122,,,,no,not present,,,,,,,274.26866,,,,,
entity,entity_1,bmse001123,20685,1,,"(E)-3,7,11,15-tetramethylhexadec-2-en-1-ol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001123,,,,no,not present,,,,,,,296.531000000001,,,,,
entity,entity_1,bmse001124,20705,1,,"5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001124,,,,no,not present,,,,,,,270.2369,,,,,
entity,entity_1,bmse001125,20726,1,,"(2E)-3,7-dimethylocta-2,6-dien-1-ol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001125,,,,no,not present,,,,,,,154.24932,,,,,
entity,entity_1,bmse001126,20747,1,,Puromycin dihydrochloride from Streptomyces alboniger,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001126,,,,no,not present,,,,,,,544.431439999998,,,,,
entity,entity_1,bmse001127,20768,1,,"5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chroman-4-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001127,,,,no,not present,,,,,,,302.27876,,,,,
entity,entity_1,bmse001128,20789,1,,"4,4,10,13,14-pentamethyl-17-(6-methylhept-5-en-2-yl)-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001128,,,,no,not present,,,,,,,426.717400000001,,,,,
entity,entity_1,bmse001129,20807,1,,Scopoletin,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001129,,,,no,not present,,,,,,,192.16812,,,,,
entity,entity_1,bmse001130,20828,1,,Spectinomycin Hydrochloride,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001130,,,,no,not present,,,,,,,332.34956,,,,,
entity,entity_1,bmse001131,20849,1,,"1,3,3-trimethyl-2-[3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohexenyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001131,,,,no,not present,,,,,,,536.872639999999,,,,,
entity,entity_1,bmse001132,20870,1,,Chenodeoxycholic acid,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001132,,,,no,not present,,,,,,,392.572000000001,,,,,
entity,entity_1,bmse001133,20890,1,,N-(4-aminobutyl)acetamide,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001133,,,,no,not present,,,,,,,130.18816,,,,,
entity,entity_1,bmse001134,20910,1,,Formiminoglycine,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001134,,,,no,not present,,,,,,,102.09194,,,,,
entity,entity_1,bmse001135,20931,1,,"17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001135,,,,no,not present,,,,,,,312.44582,,,,,
entity,entity_1,bmse001136,20952,1,,"5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001136,,,,no,not present,,,,,,,228.24328,,,,,
entity,entity_1,bmse001137,20973,1,,2-[hydroxy-[2-hydroxy-3-[(Z)-octadec-9-enoyl]oxypropoxy]phosphoryl]oxyethyl-trimethylazanium,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001137,,,,no,not present,,,,,,,522.675281,,,,,
entity,entity_1,bmse001138,20994,1,,"3,7-Dimethylocta-1,6-dien-3-ol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001138,,,,no,not present,,,,,,,154.24932,,,,,
entity,entity_1,bmse001139,21015,1,,"13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001139,,,,no,not present,,,,,,,288.38136,,,,,
entity,entity_1,bmse001140,21035,1,,"2,3-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001140,,,,no,not present,,,,,,,286.36548,,,,,
entity,entity_1,bmse001141,21056,1,,"2-methylnaphthalene-1,4-dione",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001141,,,,no,not present,,,,,,,172.18002,,,,,
entity,entity_1,bmse001142,21077,1,,2-amino-3-hydroxybutanoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001142,,,,no,not present,,,,,,,119.11916,,,,,
entity,entity_1,bmse001143,21098,1,,Rutin trihydrate,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001143,,,,no,not present,,,,,,,664.563339999999,,,,,
entity,entity_1,bmse001144,21119,1,,2-amino-3-(3H-imidazol-4-yl)propanoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001144,,,,no,not present,,,,,,,155.15456,,,,,
entity,entity_1,bmse001145,21140,1,,"(6Z,9Z,12Z)-octadeca-6,9,12-trienoic acid",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001145,,,,no,not present,,,,,,,278.4296,,,,,
entity,entity_1,bmse001146,21161,1,,"(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoic acid",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001146,,,,no,not present,,,,,,,302.451,,,,,
entity,entity_1,bmse001147,21182,1,,"2-(3,4-dihydroxyphenyl)chroman-3,5,7-triol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001147,,,,no,not present,,,,,,,290.26806,,,,,
entity,entity_1,bmse001148,21203,1,,6-Methylhept-5-en-2-one,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001148,,,,no,not present,,,,,,,126.19616,,,,,
entity,entity_1,bmse001149,21224,1,,"17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001149,,,,no,not present,,,,,,,310.42994,,,,,
entity,entity_1,bmse001150,21245,1,,"4-amino-1,2-oxazolidin-3-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001150,,,,no,not present,,,,,,,102.09194,,,,,
entity,entity_1,bmse001151,21264,1,,Methyldisulfanylmethane,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001151,,,,no,not present,,,,,,,94.19904,,,,,
entity,entity_1,bmse001152,21282,1,,methylsulfanyldisulfanylmethane,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001152,,,,no,not present,,,,,,,126.26404,,,,,
entity,entity_1,bmse001153,21302,1,,(~)-Eburnamonine,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001153,,,,no,not present,,,,,,,294.39078,,,,,
entity,entity_1,bmse001154,21323,1,,2-methyl-5-propan-2-ylphenol,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001154,,,,no,not present,,,,,,,150.21756,,,,,
entity,entity_1,bmse001155,21344,1,,"3,7-Dimethyloct-6-en-1-ol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001155,,,,no,not present,,,,,,,156.2652,,,,,
entity,entity_1,bmse001156,21365,1,,"(1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001156,,,,no,not present,,,,,,,368.3799,,,,,
entity,entity_1,bmse001157,21386,1,,"4-[4-(3,4-dihydroxyphenyl)-2,3-dimethylbutyl]benzene-1,2-diol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001157,,,,no,not present,,,,,,,302.36488,,,,,
entity,entity_1,bmse001158,21407,1,,2-amino-4-ethylsulfanylbutanoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001158,,,,no,not present,,,,,,,163.23792,,,,,
entity,entity_1,bmse001159,21428,1,,7-Hydroxyflavone,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001159,,,,no,not present,,,,,,,238.2381,,,,,
entity,entity_1,bmse001160,21449,1,,3-oxo-N-(2-oxooxolan-3-yl)dodecanamide,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001160,,,,no,not present,,,,,,,297.38988,,,,,
entity,entity_1,bmse001161,21470,1,,"3-acetamido-5-(acetyl-methylamino)-2,4,6-triiodo-N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]benzamide",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001161,,,,no,not present,,,,,,,789.09599,,,,,
entity,entity_1,bmse001162,21491,1,,AZULENE,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001162,,,,no,not present,,,,,,,128.17052,,,,,
entity,entity_1,bmse001163,21512,1,,"3-octadecoxypropane-1,2-diol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001163,,,,no,not present,,,,,,,344.572260000001,,,,,
entity,Anisole,bmse010217,30007,1,,Anisole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse001164,21532,1,,"3,16,17-trihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001164,,,,no,not present,,,,,,,302.36488,,,,,
entity,entity_1,bmse001165,21553,1,,"10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001165,,,,no,not present,,,,,,,388.669420000001,,,,,
entity,entity_1,bmse001166,21572,1,,5-Phenylpentanoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001166,,,,no,not present,,,,,,,178.22766,,,,,
entity,entity_1,bmse001167,21593,1,,"3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001167,,,,no,not present,,,,,,,286.2363,,,,,
entity,entity_1,bmse001168,21614,1,,(2-hydroxy-3-tetradecanoyloxypropyl) 2-trimethylazaniumylethyl phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001168,,,,no,not present,,,,,,,467.576901000001,,,,,
entity,entity_1,bmse001169,21634,1,,"3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-11,17-dione",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001169,,,,no,not present,,,,,,,304.42382,,,,,
entity,entity_1,bmse001170,21655,1,,"17-acetyl-3,17-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-11-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001170,,,,no,not present,,,,,,,348.47638,,,,,
entity,entity_1,bmse001171,21676,1,,"1-(3,17-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-yl)ethanone",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001171,,,,no,not present,,,,,,,334.49286,,,,,
entity,entity_1,bmse001172,21697,1,,"13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001172,,,,no,not present,,,,,,,254.36668,,,,,
entity,entity_1,bmse001173,21718,1,,"5,7-dihydroxy-3-(4-methoxyphenyl)chromen-4-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001173,,,,no,not present,,,,,,,284.26348,,,,,
entity,entity_1,bmse001174,21739,1,,Genistein,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001174,,,,no,not present,,,,,,,270.2369,,,,,
entity,entity_1,bmse001175,21760,1,,Tuftsin acetate salt hydrate,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001175,,,,no,not present,,,,,,,500.5923,,,,,
entity,entity_1,bmse001176,21781,1,,"2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001176,,,,no,not present,,,,,,,302.2357,,,,,
entity,entity_1,bmse001177,21802,1,,Protoporphyrin IX,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001177,,,,no,not present,,,,,,,562.658159999998,,,,,
entity,entity_1,bmse001178,21823,1,,"(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001178,,,,no,not present,,,,,,,304.46688,,,,,
entity,entity_1,bmse001179,21844,1,,"3,4,5-trihydroxycyclohexene-1-carboxylic acid",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001179,,,,no,not present,,,,,,,174.1513,,,,,
entity,entity_1,bmse001180,21865,1,,4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-4-ol hydrate,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001180,,,,no,not present,,,,,,,172.2646,,,,,
entity,entity_1,bmse001181,21886,1,,3-Methylbutanal,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001181,,,,no,not present,,,,,,,86.1323000000001,,,,,
entity,entity_1,bmse001182,21907,1,,"1-(1H-indol-3-yl)-N,N-dimethylmethanamine",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001182,,,,no,not present,,,,,,,174.24226,,,,,
entity,entity_1,bmse001183,21928,1,,"6-hydroxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001183,,,,no,not present,,,,,,,274.35478,,,,,
entity,entity_1,bmse001184,21949,1,,Chartreusin from Streptomyces chartreusis,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001184,,,,no,not present,,,,,,,640.588079999999,,,,,
entity,entity_1,bmse001185,21970,1,,"4,7,7-trimethyl-8-oxabicyclo[2.2.2]octane",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001185,,,,no,not present,,,,,,,154.24932,,,,,
entity,entity_1,bmse001186,21991,1,,"2-methyl-5-propan-2-ylcyclohexa-1,3-diene",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001186,,,,no,not present,,,,,,,136.23404,,,,,
entity,entity_1,bmse001187,22012,1,,"5-hydroxy-2-methylnaphthalene-1,4-dione",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001187,,,,no,not present,,,,,,,188.17942,,,,,
entity,entity_1,bmse001188,22033,1,,2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001188,,,,no,not present,,,,,,,266.33432,,,,,
entity,entity_1,bmse001189,22054,1,,2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphenol,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001189,,,,no,not present,,,,,,,266.33432,,,,,
entity,entity_1,bmse001190,22075,1,,Ellagic acid,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001190,,,,no,not present,,,,,,,302.19264,,,,,
entity,entity_1,bmse001191,22096,1,,5-Methylfuran-2-carbaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001191,,,,no,not present,,,,,,,110.11064,,,,,
entity,entity_1,bmse001192,22117,1,,"5-CHLORO-2-(2,4-DICHLOROPHENOXY)PHENOL",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001192,,,,no,not present,,,,,,,289.54178,,,,,
entity,entity_1,bmse001193,22138,1,,Berberine chloride,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001193,,,,no,not present,,,,,,,371.81422,,,,,
entity,entity_1,bmse001194,22159,1,,Methyl 4-hydroxybenzoate,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001194,,,,no,not present,,,,,,,152.14732,,,,,
entity,entity_1,bmse001195,22180,1,,2-prop-2-enylphenol,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001195,,,,no,not present,,,,,,,134.1751,,,,,
entity,entity_1,bmse001196,22201,1,,5-hydroxy-2-(hydroxymethyl)pyran-4-one,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001196,,,,no,not present,,,,,,,142.10944,,,,,
entity,entity_1,bmse001197,22222,1,,(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001197,,,,no,not present,,,,,,,320.3371,,,,,
entity,entity_1,bmse001198,22243,1,,Acenaphthene,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001198,,,,no,not present,,,,,,,154.2078,,,,,
entity,entity_1,bmse001199,22264,1,,benzyl-dimethyl-tetradecylazanium chloride,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001199,,,,no,not present,,,,,,,368.039280000001,,,,,
entity,entity_1,bmse001200,22285,1,,2-[2-[2-[2-(Bis(carboxymethyl)amino)ethoxy]ethoxy]ethyl-(carboxymethyl)amino]acetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001200,,,,no,not present,,,,,,,380.34776,,,,,
entity,entity_1,bmse001201,22305,1,,"1-hydroxyanthracene-9,10-dione",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001201,,,,no,not present,,,,,,,224.21152,,,,,
entity,entity_1,bmse001202,22326,1,,2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one,non-polymer,,,,,,,,,,no,no,no,no,no,BMET001202,,,,no,not present,,,,,,,150.21756,,,,,
entity,entity_1,bmse001203,22347,1,,"4-hydroxy-2,5-dimethylfuran-3-one",non-polymer,,,,,,,,,,no,no,no,no,no,BMET001203,,,,no,not present,,,,,,,128.12592,,,,,
entity,entity_1,bmse001204,22370,1,,2-METHYL-BICYCLO(2.2.1)HEPT-5-ENE-2-CARBOXYLIC ACID,non-polymer,,,,,,,,,,no,no,,,no,BMET001204,chem_comp_1,1,1,no,not present,,,,,,,152.19038,,,,,
entity,entity_1,bmse001205,22394,1,,D-Norvaline,non-polymer,,,,,,,,,,no,no,,,no,BMET001205,chem_comp_1,1,1,no,not present,,,,,,,117.14634,,,,,
entity,entity_1,bmse001206,22418,1,,Haloperidol,non-polymer,,,,,,,,,,no,no,,,no,BMET001206,chem_comp_1,1,1,no,not present,,,,,,,375.8642232,,,,,
entity,entity_1,bmse001207,22442,1,,Isonicotinamide,non-polymer,,,,,,,,,,no,no,,,no,BMET001207,chem_comp_1,1,1,no,not present,,,,,,,122.12464,,,,,
entity,entity_1,bmse001208,22466,1,,Myrcene,non-polymer,,,,,,,,,,no,no,,,no,BMET001208,chem_comp_1,1,1,no,not present,,,,,,,136.23404,,,,,
entity,entity_1,bmse001209,22490,1,,(-)-Isoproterenol hydrochloride,non-polymer,,,,,,,,,,no,no,,,no,BMET001209,chem_comp_1,1,1,no,not present,,,,,,,211.25758,,,,,
entity,entity_1,bmse001210,22514,1,,Loperamide hydrochloride,non-polymer,,,,,,,,,,no,no,,,no,BMET001210,chem_comp_1,1,1,no,not present,,,,,,,477.03752,,,,,
entity,entity_1,bmse001211,22538,1,,Dichloroisoproterenol hydrochloride,non-polymer,,,,,,,,,,no,no,,,no,BMET001211,chem_comp_1,1,1,no,not present,,,,,,,248.1489,,,,,
entity,entity_1,bmse001212,22562,1,,2-Nitrophenyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside,non-polymer,,,,,,,,,,no,no,,,no,BMET001212,chem_comp_1,1,1,no,not present,,,,,,,342.30132,,,,,
entity,entity_1,bmse001213,22586,1,,Pleurotine,non-polymer,,,,,,,,,,no,no,,,no,BMET001213,chem_comp_1,1,1,no,not present,,,,,,,354.39638,,,,,
entity,entity_1,bmse001214,22610,1,,beta-Yohimbine,non-polymer,,,,,,,,,,no,no,,,no,BMET001214,chem_comp_1,1,1,no,not present,,,,,,,354.44274,,,,,
entity,entity_1,bmse001215,22634,1,,Sequiterpene lactone 326,non-polymer,,,,,,,,,,no,no,,,no,BMET001215,chem_comp_1,1,1,no,not present,,,,,,,264.3169,,,,,
entity,entity_1,bmse001216,22658,1,,Coumestrol,non-polymer,,,,,,,,,,no,no,,,no,BMET001216,chem_comp_1,1,1,no,not present,,,,,,,268.22102,,,,,
entity,entity_1,bmse001217,22682,1,,Bactobolin,non-polymer,,,,,,,,,,no,no,,,no,BMET001217,chem_comp_1,1,1,no,not present,,,,,,,383.2244,,,,,
entity,entity_1,bmse001218,22706,1,,LONCHOCARPIC ACID,non-polymer,,,,,,,,,,no,no,,,no,BMET001218,chem_comp_1,1,1,no,not present,,,,,,,434.48104,,,,,
entity,entity_1,bmse001219,22730,1,,Pyrethrosin,non-polymer,,,,,,,,,,no,no,,,no,BMET001219,chem_comp_1,1,1,no,not present,,,,,,,306.35358,,,,,
entity,entity_1,bmse001220,22754,1,,Pubescine,non-polymer,,,,,,,,,,no,no,,,no,BMET001220,chem_comp_1,1,1,no,not present,,,,,,,382.45284,,,,,
entity,entity_1,bmse001221,22778,1,,(-)-Ambroxide,non-polymer,,,,,,,,,,no,no,,,no,BMET001221,chem_comp_1,1,1,no,not present,,,,,,,236.39292,,,,,
entity,entity_1,bmse001222,22802,1,,LDCast,non-polymer,,,,,,,,,,no,no,,,no,BMET001222,chem_comp_1,1,1,no,not present,,,,,,,189.209,,,,,
entity,entity_1,bmse001223,22826,1,,Guaiacol glyceryl ether carbamate,non-polymer,,,,,,,,,,no,no,,,no,BMET001223,chem_comp_1,1,1,no,not present,,,,,,,241.2405,,,,,
entity,entity_1,bmse001224,22850,1,,Ginkgotoxin,non-polymer,,,,,,,,,,no,no,,,no,BMET001224,chem_comp_1,1,1,no,not present,,,,,,,183.20442,,,,,
entity,entity_1,bmse001225,22873,1,,Arecoline hydrobromide,non-polymer,,,,,,,,,,no,no,,,no,BMET001225,chem_comp_1,1,1,no,not present,,,,,,,155.19432,,,,,
entity,entity_1,bmse001226,22897,1,,Isoborneol,non-polymer,,,,,,,,,,no,no,,,no,BMET001226,chem_comp_1,1,1,no,not present,,,,,,,154.24932,,,,,
entity,entity_1,bmse001227,22921,1,,DL-Kavain,non-polymer,,,,,,,,,,no,no,,,no,BMET001227,chem_comp_1,1,1,no,not present,,,,,,,230.25916,,,,,
entity,entity_1,bmse001228,22945,1,,Zeatin,non-polymer,,,,,,,,,,no,no,,,no,BMET001228,chem_comp_1,1,1,no,not present,,,,,,,219.24312,,,,,
entity,entity_1,bmse001229,22969,1,,Tropinone,non-polymer,,,,,,,,,,no,no,,,no,BMET001229,chem_comp_1,1,1,no,not present,,,,,,,139.19492,,,,,
entity,entity_1,bmse001230,22993,1,,Camphor,non-polymer,,,,,,,,,,no,no,,,no,BMET001230,chem_comp_1,1,1,no,not present,,,,,,,152.23344,,,,,
entity,entity_1,bmse001231,23017,1,,Formononetin,non-polymer,,,,,,,,,,no,no,,,no,BMET001231,chem_comp_1,1,1,no,not present,,,,,,,268.26408,,,,,
entity,entity_1,bmse001232,23041,1,,Methoxsalen,non-polymer,,,,,,,,,,no,no,,,no,BMET001232,chem_comp_1,1,1,no,not present,,,,,,,216.18952,,,,,
entity,entity_1,bmse001233,23065,1,,(-)-alpha-Santonin,non-polymer,,,,,,,,,,no,no,,,no,BMET001233,chem_comp_1,1,1,no,not present,,,,,,,246.30162,,,,,
entity,entity_1,bmse001234,23089,1,,Canadine,non-polymer,,,,,,,,,,no,no,,,no,BMET001234,chem_comp_1,1,1,no,not present,,,,,,,339.38504,,,,,
entity,entity_1,bmse001235,23113,1,,Piperine,non-polymer,,,,,,,,,,no,no,,,no,BMET001235,chem_comp_1,1,1,no,not present,,,,,,,285.33766,,,,,
entity,entity_1,bmse001236,23137,1,,4-Hydroxytamoxifen,non-polymer,,,,,,,,,,no,no,,,no,BMET001236,chem_comp_1,1,1,no,not present,,,,,,,387.51396,,,,,
entity,entity_1,bmse001237,23161,1,,Nalidixic acid sodium salt,non-polymer,,,,,,,,,,no,no,,,no,BMET001237,chem_comp_1,1,1,no,not present,,,,,,,232.23528,,,,,
entity,entity_1,bmse001238,23185,1,,(+)-Abscisic acid,non-polymer,,,,,,,,,,no,no,,,no,BMET001238,chem_comp_1,1,1,no,not present,,,,,,,264.3169,,,,,
entity,entity_1,bmse001239,23209,1,,Hordenine,non-polymer,,,,,,,,,,no,no,,,no,BMET001239,chem_comp_1,1,1,no,not present,,,,,,,165.2322,,,,,
entity,entity_1,bmse001240,23233,1,,Papaverine hydrochloride,non-polymer,,,,,,,,,,no,no,,,no,BMET001240,chem_comp_1,1,1,no,not present,,,,,,,339.38504,,,,,
entity,entity_1,bmse001241,23257,1,,Capsaicin,non-polymer,,,,,,,,,,no,no,,,no,BMET001241,chem_comp_1,1,1,no,not present,,,,,,,305.41188,,,,,
entity,entity_1,bmse001242,23281,1,,Probucol,non-polymer,,,,,,,,,,no,no,,,no,BMET001242,chem_comp_1,1,1,no,not present,,,,,,,516.84162,,,,,
entity,entity_1,bmse001243,23305,1,,Rotenone,non-polymer,,,,,,,,,,no,no,,,no,BMET001243,chem_comp_1,1,1,no,not present,,,,,,,394.41718,,,,,
entity,entity_1,bmse001244,23329,1,,Riluzole,non-polymer,,,,,,,,,,no,no,,,no,BMET001244,chem_comp_1,1,1,no,not present,,,,,,,234.1983096,,,,,
entity,entity_1,bmse001245,23353,1,,Chelidonic acid,non-polymer,,,,,,,,,,no,no,,,no,BMET001245,chem_comp_1,1,1,no,not present,,,,,,,184.10306,,,,,
entity,entity_1,bmse001246,23377,1,,Cis-Jasmone,non-polymer,,,,,,,,,,no,no,,,no,BMET001246,chem_comp_1,1,1,no,not present,,,,,,,164.24414,,,,,
entity,entity_1,bmse001247,23401,1,,Diosgenin,non-polymer,,,,,,,,,,no,no,,,no,BMET001247,chem_comp_1,1,1,no,not present,,,,,,,414.62058,,,,,
entity,entity_1,bmse001248,23425,1,,Boldine,non-polymer,,,,,,,,,,no,no,,,no,BMET001248,chem_comp_1,1,1,no,not present,,,,,,,327.37434,,,,,
entity,entity_1,bmse001249,23449,1,,Artemisinin,non-polymer,,,,,,,,,,no,no,,,no,BMET001249,chem_comp_1,1,1,no,not present,,,,,,,282.33218,,,,,
entity,entity_1,bmse001250,23473,1,,Isocorydine,non-polymer,,,,,,,,,,no,no,,,no,BMET001250,chem_comp_1,1,1,no,not present,,,,,,,341.40092,,,,,
entity,entity_1,bmse001251,23497,1,,Noscapine hydrochloride hydrate,non-polymer,,,,,,,,,,no,no,,,no,BMET001251,chem_comp_1,1,1,no,not present,,,,,,,413.42052,,,,,
entity,entity_1,bmse001252,23521,1,,beta-Caryophyllene,non-polymer,,,,,,,,,,no,no,,,no,BMET001252,chem_comp_1,1,1,no,not present,,,,,,,204.35106,,,,,
entity,entity_1,bmse001253,23545,1,,Guaiazulene,non-polymer,,,,,,,,,,no,no,,,no,BMET001253,chem_comp_1,1,1,no,not present,,,,,,,198.30342,,,,,
entity,entity_1,bmse001302,24721,1,,Taxifolin,non-polymer,,,,,,,,,,no,no,,,no,BMET001302,chem_comp_1,1,1,no,not present,,,,,,,304.25158,,,,,
entity,entity_1,bmse001254,23569,1,,trans-Nerolidol,non-polymer,,,,,,,,,,no,no,,,no,BMET001254,chem_comp_1,1,1,no,not present,,,,,,,222.36634,,,,,
entity,entity_1,bmse001255,23593,1,,(-)-Epicatechin,non-polymer,,,,,,,,,,no,no,,,no,BMET001255,chem_comp_1,1,1,no,not present,,,,,,,290.26806,,,,,
entity,entity_1,bmse001256,23617,1,,(R)-(+)-Pulegone,non-polymer,,,,,,,,,,no,no,,,no,BMET001256,chem_comp_1,1,1,no,not present,,,,,,,152.23344,,,,,
entity,entity_1,bmse001257,23641,1,,Diosmetin,non-polymer,,,,,,,,,,no,no,,,no,BMET001257,chem_comp_1,1,1,no,not present,,,,,,,300.26288,,,,,
entity,entity_1,bmse001258,23665,1,,Aloin,non-polymer,,,,,,,,,,no,no,,,no,BMET001258,chem_comp_1,1,1,no,not present,,,,,,,418.39398,,,,,
entity,entity_1,bmse001259,23689,1,,Chrysophanol,non-polymer,,,,,,,,,,no,no,,,no,BMET001259,chem_comp_1,1,1,no,not present,,,,,,,254.2375,,,,,
entity,entity_1,bmse001260,23713,1,,2-(Hydroxymethyl)anthraquinone,non-polymer,,,,,,,,,,no,no,,,no,BMET001260,chem_comp_1,1,1,no,not present,,,,,,,238.2381,,,,,
entity,entity_1,bmse001261,23737,1,,Chicoric Acid,non-polymer,,,,,,,,,,no,no,,,no,BMET001261,chem_comp_1,1,1,no,not present,,,,,,,474.37112,,,,,
entity,entity_1,bmse001262,23761,1,,4-Allylanisole,non-polymer,,,,,,,,,,no,no,,,no,BMET001262,chem_comp_1,1,1,no,not present,,,,,,,148.20168,,,,,
entity,entity_1,bmse001263,23785,1,,"4-Allyl-1,2-dimethoxybenzene",non-polymer,,,,,,,,,,no,no,,,no,BMET001263,chem_comp_1,1,1,no,not present,,,,,,,178.22766,,,,,
entity,entity_1,bmse001264,23809,1,,Myristicin,non-polymer,,,,,,,,,,no,no,,,no,BMET001264,chem_comp_1,1,1,no,not present,,,,,,,192.21118,,,,,
entity,entity_1,bmse001265,23833,1,,Safrole,non-polymer,,,,,,,,,,no,no,,,no,BMET001265,chem_comp_1,1,1,no,not present,,,,,,,162.1852,,,,,
entity,entity_1,bmse001266,23857,1,,rottlerin,non-polymer,,,,,,,,,,no,no,,,no,BMET001266,chem_comp_1,1,1,no,not present,,,,,,,516.53852,,,,,
entity,entity_1,bmse001267,23881,1,,Sesamol,non-polymer,,,,,,,,,,no,no,,,no,BMET001267,chem_comp_1,1,1,no,not present,,,,,,,138.12074,,,,,
entity,entity_1,bmse001268,23905,1,,3-Carene,non-polymer,,,,,,,,,,no,no,,,no,BMET001268,chem_comp_1,1,1,no,not present,,,,,,,136.23404,,,,,
entity,entity_1,bmse001269,23929,1,,beta-Ionone,non-polymer,,,,,,,,,,no,no,,,no,BMET001269,chem_comp_1,1,1,no,not present,,,,,,,192.2973,,,,,
entity,entity_1,bmse001270,23953,1,,Vinpocetine,non-polymer,,,,,,,,,,no,no,,,no,BMET001270,chem_comp_1,1,1,no,not present,,,,,,,350.45404,,,,,
entity,entity_1,bmse001271,23977,1,,Proglumide sodium salt,non-polymer,,,,,,,,,,no,no,,,no,BMET001271,chem_comp_1,1,1,no,not present,,,,,,,334.41004,,,,,
entity,entity_1,bmse001272,24001,1,,Myricetin,non-polymer,,,,,,,,,,no,no,,,no,BMET001272,chem_comp_1,1,1,no,not present,,,,,,,318.2351,,,,,
entity,entity_1,bmse001273,24025,1,,Simvastatin,non-polymer,,,,,,,,,,no,no,,,no,BMET001273,chem_comp_1,1,1,no,not present,,,,,,,418.56622,,,,,
entity,entity_1,bmse001274,24049,1,,Isophorone,non-polymer,,,,,,,,,,no,no,,,no,BMET001274,chem_comp_1,1,1,no,not present,,,,,,,138.20686,,,,,
entity,entity_1,bmse001275,24073,1,,Vitamin K1,non-polymer,,,,,,,,,,no,no,,,no,BMET001275,chem_comp_1,1,1,no,not present,,,,,,,450.69574,,,,,
entity,entity_1,bmse001276,24097,1,,Luteolin,non-polymer,,,,,,,,,,no,no,,,no,BMET001276,chem_comp_1,1,1,no,not present,,,,,,,286.2363,,,,,
entity,entity_1,bmse001277,24121,1,,Sparstolonin B,non-polymer,,,,,,,,,,no,no,,,no,BMET001277,chem_comp_1,1,1,no,not present,,,,,,,268.22102,,,,,
entity,entity_1,bmse001278,24145,1,,Bicuculline,non-polymer,,,,,,,,,,no,no,,,no,BMET001278,chem_comp_1,1,1,no,not present,,,,,,,367.35208,,,,,
entity,entity_1,bmse001279,24169,1,,Aspergillic acid,non-polymer,,,,,,,,,,no,no,,,no,BMET001279,chem_comp_1,1,1,no,not present,,,,,,,224.2994,,,,,
entity,entity_1,bmse001280,24193,1,,Aleuritic acid,non-polymer,,,,,,,,,,no,no,,,no,BMET001280,chem_comp_1,1,1,no,not present,,,,,,,304.42228,,,,,
entity,entity_1,bmse001281,24217,1,,Noscapine hydrochloride,non-polymer,,,,,,,,,,no,no,,,no,BMET001281,chem_comp_1,1,1,no,not present,,,,,,,413.42052,,,,,
entity,entity_1,bmse001282,24241,1,,Daphnetin diacetate,non-polymer,,,,,,,,,,no,no,,,no,BMET001282,chem_comp_1,1,1,no,not present,,,,,,,262.2149,,,,,
entity,entity_1,bmse001283,24265,1,,Picrotin,non-polymer,,,,,,,,,,no,no,,,no,BMET001283,chem_comp_1,1,1,no,not present,,,,,,,310.29922,,,,,
entity,entity_1,bmse001284,24289,1,,Pomiferin,non-polymer,,,,,,,,,,no,no,,,no,BMET001284,chem_comp_1,1,1,no,not present,,,,,,,420.45446,,,,,
entity,entity_1,bmse001285,24313,1,,Radicinin,non-polymer,,,,,,,,,,no,no,,,no,BMET001285,chem_comp_1,1,1,no,not present,,,,,,,236.22068,,,,,
entity,entity_1,bmse001286,24337,1,,Hispanolone,non-polymer,,,,,,,,,,no,no,,,no,BMET001286,chem_comp_1,1,1,no,not present,,,,,,,318.4504,,,,,
entity,entity_1,bmse001287,24361,1,,Dehydroabietic acid,non-polymer,,,,,,,,,,no,no,,,no,BMET001287,chem_comp_1,1,1,no,not present,,,,,,,300.43512,,,,,
entity,entity_1,bmse001288,24385,1,,Quadrone,non-polymer,,,,,,,,,,no,no,,,no,BMET001288,chem_comp_1,1,1,no,not present,,,,,,,248.3175,,,,,
entity,entity_1,bmse001289,24409,1,,Gelcohol,non-polymer,,,,,,,,,,no,no,,,no,BMET001289,chem_comp_1,1,1,no,not present,,,,,,,282.37524,,,,,
entity,entity_1,bmse001290,24433,1,,Medicarpin,non-polymer,,,,,,,,,,no,no,,,no,BMET001290,chem_comp_1,1,1,no,not present,,,,,,,270.27996,,,,,
entity,entity_1,bmse001291,24457,1,,Fastigillin B,non-polymer,,,,,,,,,,no,no,,,no,BMET001291,chem_comp_1,1,1,no,not present,,,,,,,362.41684,,,,,
entity,entity_1,bmse001292,24481,1,,Confertifoline,non-polymer,,,,,,,,,,no,no,,,no,BMET001292,chem_comp_1,1,1,no,not present,,,,,,,234.33398,,,,,
entity,entity_1,bmse001293,24505,1,,Pentoxifylline,non-polymer,,,,,,,,,,no,no,,,no,BMET001293,chem_comp_1,1,1,no,not present,,,,,,,278.30702,,,,,
entity,entity_1,bmse001294,24529,1,,Parthenolide,non-polymer,,,,,,,,,,no,no,,,no,BMET001294,chem_comp_1,1,1,no,not present,,,,,,,248.3175,,,,,
entity,entity_1,bmse001295,24553,1,,3-(4-Hydroxyphenyl)propionic acid,non-polymer,,,,,,,,,,no,no,,,no,BMET001295,chem_comp_1,1,1,no,not present,,,,,,,166.1739,,,,,
entity,entity_1,bmse001296,24577,1,,Betulin,non-polymer,,,,,,,,,,no,no,,,no,BMET001296,chem_comp_1,1,1,no,not present,,,,,,,442.7168,,,,,
entity,entity_1,bmse001297,24601,1,,Emodin,non-polymer,,,,,,,,,,no,no,,,no,BMET001297,chem_comp_1,1,1,no,not present,,,,,,,270.2369,,,,,
entity,entity_1,bmse001298,24625,1,,Daidzein,non-polymer,,,,,,,,,,no,no,,,no,BMET001298,chem_comp_1,1,1,no,not present,,,,,,,254.2375,,,,,
entity,entity_1,bmse001299,24649,1,,Parthenin,non-polymer,,,,,,,,,,no,no,,,no,BMET001299,chem_comp_1,1,1,no,not present,,,,,,,262.30102,,,,,
entity,entity_1,bmse001300,24673,1,,Dihydroisorescinnamine,non-polymer,,,,,,,,,,no,no,,,no,BMET001300,chem_comp_1,1,1,no,not present,,,,,,,636.73186,,,,,
entity,entity_1,bmse001301,24697,1,,"Norlobaric acid, decarboxy-",non-polymer,,,,,,,,,,no,no,,,no,BMET001301,chem_comp_1,1,1,no,not present,,,,,,,398.44894,,,,,
entity,entity_1,bmse001303,24745,1,,Pseudoyohimbine,non-polymer,,,,,,,,,,no,no,,,no,BMET001303,chem_comp_1,1,1,no,not present,,,,,,,354.44274,,,,,
entity,entity_1,bmse001304,24769,1,,Beta-Lapachone,non-polymer,,,,,,,,,,no,no,,,no,BMET001304,chem_comp_1,1,1,no,not present,,,,,,,242.26986,,,,,
entity,entity_1,bmse001305,24793,1,,Himbacine,non-polymer,,,,,,,,,,no,no,,,no,BMET001305,chem_comp_1,1,1,no,not present,,,,,,,345.5188,,,,,
entity,entity_1,bmse001306,24817,1,,Atorvastatin,non-polymer,,,,,,,,,,no,no,,,no,BMET001306,chem_comp_1,1,1,no,not present,,,,,,,558.6398032,,,,,
entity,entity_1,bmse001307,24841,1,,Cordycepin,non-polymer,,,,,,,,,,no,no,,,no,BMET001307,chem_comp_1,1,1,no,not present,,,,,,,251.24192,,,,,
entity,entity_1,bmse001308,24865,1,,Neohesperidin,non-polymer,,,,,,,,,,no,no,,,no,BMET001308,chem_comp_1,1,1,no,not present,,,,,,,610.56056,,,,,
entity,entity_1,bmse001309,24889,1,,Madecassic acid,non-polymer,,,,,,,,,,no,no,,,no,BMET001309,chem_comp_1,1,1,no,not present,,,,,,,504.69852,,,,,
entity,entity_1,bmse001310,24913,1,,Stictic acid,non-polymer,,,,,,,,,,no,no,,,no,BMET001310,chem_comp_1,1,1,no,not present,,,,,,,386.30906,,,,,
entity,entity_1,bmse001311,24937,1,,Ascochitine,non-polymer,,,,,,,,,,no,no,,,no,BMET001311,chem_comp_1,1,1,no,not present,,,,,,,276.28454,,,,,
entity,entity_1,bmse001312,24961,1,,Patchouli alcohol,non-polymer,,,,,,,,,,no,no,,,no,BMET001312,chem_comp_1,1,1,no,not present,,,,,,,222.36634,,,,,
entity,entity_1,bmse001313,24985,1,,Magnolin,non-polymer,,,,,,,,,,no,no,,,no,BMET001313,chem_comp_1,1,1,no,not present,,,,,,,416.46422,,,,,
entity,entity_1,bmse001314,25009,1,,Genipin,non-polymer,,,,,,,,,,no,no,,,no,BMET001314,chem_comp_1,1,1,no,not present,,,,,,,226.22586,,,,,
entity,entity_1,bmse001315,25033,1,,Bakuchiol,non-polymer,,,,,,,,,,no,no,,,no,BMET001315,chem_comp_1,1,1,no,not present,,,,,,,256.38256,,,,,
entity,entity_1,bmse001316,25057,1,,Cardamonin,non-polymer,,,,,,,,,,no,no,,,no,BMET001316,chem_comp_1,1,1,no,not present,,,,,,,270.27996,,,,,
entity,entity_1,bmse001317,25081,1,,Panaxatriol,non-polymer,,,,,,,,,,no,no,,,no,BMET001317,chem_comp_1,1,1,no,not present,,,,,,,476.73148,,,,,
entity,entity_1,bmse001318,25105,1,,Silibinin,non-polymer,,,,,,,,,,no,no,,,no,BMET001318,chem_comp_1,1,1,no,not present,,,,,,,482.43618,,,,,
entity,entity_1,bmse001319,25129,1,,(-)-dehydrocostuslactone,non-polymer,,,,,,,,,,no,no,,,no,BMET001319,chem_comp_1,1,1,no,not present,,,,,,,230.30222,,,,,
entity,entity_1,bmse001320,25153,1,,Galangin,non-polymer,,,,,,,,,,no,no,,,no,BMET001320,chem_comp_1,1,1,no,not present,,,,,,,270.2369,,,,,
entity,entity_1,bmse001321,25177,1,,Pterostilbene,non-polymer,,,,,,,,,,no,no,,,no,BMET001321,chem_comp_1,1,1,no,not present,,,,,,,256.29644,,,,,
entity,entity_1,bmse001322,25201,1,,Purpurin,non-polymer,,,,,,,,,,no,no,,,no,BMET001322,chem_comp_1,1,1,no,not present,,,,,,,256.21032,,,,,
entity,entity_1,bmse001323,25225,1,,Paeonol,non-polymer,,,,,,,,,,no,no,,,no,BMET001323,chem_comp_1,1,1,no,not present,,,,,,,166.1739,,,,,
entity,entity_1,bmse001324,25249,1,,Camptothecin,non-polymer,,,,,,,,,,no,no,,,no,BMET001324,chem_comp_1,1,1,no,not present,,,,,,,348.35204,,,,,
entity,entity_1,bmse001325,25273,1,,Maslinic acid,non-polymer,,,,,,,,,,no,no,,,no,BMET001325,chem_comp_1,1,1,no,not present,,,,,,,472.69972,,,,,
entity,entity_1,bmse001326,25297,1,,2'-Fucosyllactose,non-polymer,,,,,,,,,,no,no,,,no,BMET001326,2_Fucosyllactose,1,1,no,not present,,,,,,,488.43768,,,,,
entity,entity_1,bmse001327,25330,1,,Lacto-N-tetraose,non-polymer,,,,,,,,,,no,no,,,no,BMET001327,Lacto_N_tetraose,1,1,no,not present,,,,,,,707.6296,,,,,
entity,entity_1,bmse001328,25363,1,,Lacto-N-fucopentaitolI,non-polymer,,,,,,,,,,no,no,,,no,BMET001328,Lacto-N-fucopentaitolI,1,1,no,not present,,,,,,,853.7708,,,,,
entity,entity_1,bmse001329,25396,1,,3'-Sialyllactose Sodium Salt,non-polymer,,,,,,,,,,no,no,,,no,BMET001329,3_Sialyllactose_Sodium_Salt,1,1,no,not present,,,,,,,655.53289,,,,,
entity,entity_1,bmse001330,25429,1,,3-Fucosyllactose,non-polymer,,,,,,,,,,no,no,,,no,BMET001330,3-Fucosyllactose,1,1,no,not present,,,,,,,488.43768,,,,,
entity,entity_1,bmse001331,25462,1,,6'-Sialyllactose sodium salt,non-polymer,,,,,,,,,,no,no,,,no,BMET001331,6_Sialyllactose_sodium_salt,1,1,no,not present,,,,,,,633.55106,,,,,
entity,entity_1,bmse001332,25495,1,,LNnT,non-polymer,,,,,,,,,,no,no,,,no,BMET001332,LNnT,1,1,no,not present,,,,,,,707.6296,,,,,
entity,entity_1,bmse001333,25528,1,,Tanshinone IIA,non-polymer,,,,,,,,,,no,no,,,no,BMET001333,Tanshinone_IIA,1,1,no,not present,,,,,,,294.34442,,,,,
entity,entity_1,bmse001334,25552,1,,Schisandrin,non-polymer,,,,,,,,,,no,no,,,no,BMET001334,Schisandrin,1,1,no,not present,,,,,,,432.50668,,,,,
entity,entity_1,bmse001335,25576,1,,Lovastatin,non-polymer,,,,,,,,,,no,no,,,no,BMET001335,Lovastatin,1,1,no,not present,,,,,,,404.53964,,,,,
entity,entity_1,bmse001336,25600,1,,Tangeretin,non-polymer,,,,,,,,,,no,no,,,no,BMET001336,Tangeretin,1,1,no,not present,,,,,,,372.3686,,,,,
entity,entity_1,bmse001337,25624,1,,Estradiene dione-3-keta,non-polymer,,,,,,,,,,no,no,,,no,BMET001337,Estradiene_dione_3_keta,1,1,no,not present,,,,,,,314.41864,,,,,
entity,entity_1,bmse001338,25648,1,,4-Ipomeanol,non-polymer,,,,,,,,,,no,no,,,no,BMET001338,4_Ipomeanol,1,1,no,not present,,,,,,,168.18978,,,,,
entity,entity_1,bmse001339,25672,1,,Streptonigrin,non-polymer,,,,,,,,,,no,no,,,no,BMET001339,Streptonigrin,1,1,no,not present,,,,,,,506.46418,,,,,
entity,entity_1,bmse001340,25696,1,,Ellipticine,non-polymer,,,,,,,,,,no,no,,,no,BMET001340,Ellipticine,1,1,no,not present,,,,,,,246.30646,,,,,
entity,entity_1,bmse001341,25720,1,,Colchicine,non-polymer,,,,,,,,,,no,no,,,no,BMET001341,Colchicine,1,1,no,not present,,,,,,,399.437,,,,,
entity,entity_1,bmse001342,25744,1,,Daunorubicin,non-polymer,,,,,,,,,,no,no,,,no,BMET001342,Daunorubicin,1,1,no,not present,,,,,,,527.51986,,,,,
entity,entity_1,bmse001343,25768,1,,Voglibose,non-polymer,,,,,,,,,,no,no,,,no,BMET001343,Voglibose,1,1,no,not present,,,,,,,267.27624,,,,,
entity,1-(4-Hydroxyphenyl)ethanol,bmse010001,25789,1,,1-(4-Hydroxyphenyl)ethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Apocynol,bmse010002,25809,1,,Apocynol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,"1-(4-Hydroxy-3,5-dimethoxyphenyl)ethanol",bmse010003,25829,1,,"1-(4-Hydroxy-3,5-dimethoxyphenyl)ethanol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010004,25849,1,,"1-(3,4-Dimethoxyphenyl)ethanol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Hydroxybenzaldehyde,bmse010005,25869,1,,p-Hydroxybenzaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Vanillin,bmse010006,25889,1,,Vanillin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringyl-alcohol,bmse010007,25909,1,,Syringyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-S-r-S,bmse010110,27909,1,,G-b-S-r-S,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methyl-4-acetoxybenzoate,bmse010008,25929,1,,Methyl-4-acetoxybenzoate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methyl-4-hydroxybenzoate,bmse010009,25949,1,,Methyl-4-hydroxybenzoate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Hydroxy-3-methoxybenzyl-alcohol,bmse010010,25969,1,,4-Hydroxy-3-methoxybenzyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010011,25989,1,,"2,3-Diacetoxypropioveratrone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Anisic-acid,bmse010012,26009,1,,p-Anisic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_22,bmse010013,26029,1,,"2-(2,6-Dimethoxyphenoxy)-1-(4-hydroxy-3,5-dimethoxyphenyl)ethanone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Hydroxyphenylethanol-diacetate,bmse010014,26049,1,,Hydroxyphenylethanol-diacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-acetoxybenzyl-acetate,bmse010015,26069,1,,4-acetoxybenzyl-acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methyl-p-anisate,bmse010016,26089,1,,Methyl-p-anisate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_26,bmse010017,26109,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-2-(2,6-dmethoxyphenoxy)ethanone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_27,bmse010018,26129,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-2-(2-methoxyphenoxy)ethanone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dehydrodivanillin,bmse010019,26149,1,,Dehydrodivanillin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_29,bmse010020,26166,1,,Veratrylglycerol-B-syringol-ether-triacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2,bmse010021,26186,1,,"1-(3,4-Dimethoxyphenyl)-2-[4-(1-hydroxyethyl)-2,6-dimethoxyphenoxy]propane-1,3-diol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Xylan,bmse010022,26206,1,,Xylan,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dihydroferulic-Acid,bmse010023,26220,1,,Dihydroferulic-Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Methoxyacetophenone,bmse010024,26240,1,,4-Methoxyacetophenone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Methoxybenzyl-alcohol,bmse010025,26260,1,,p-Methoxybenzyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phenol,bmse010026,26280,1,,Phenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Guaiacol,bmse010027,26300,1,,Guaiacol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Hydroxybenzyl-alcohol,bmse010028,26320,1,,p-Hydroxybenzyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010029,26340,1,,"3,4-Dimethoxybenzyl-alcohol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Hydroxyacetophenone,bmse010030,26360,1,,p-Hydroxyacetophenone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetovanillone,bmse010031,26380,1,,Acetovanillone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetosyringone,bmse010032,26400,1,,Acetosyringone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetoveratrone,bmse010033,26420,1,,Acetoveratrone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1001,bmse010034,26440,1,,lignin_cw_compound_1001,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1002,bmse010035,26454,1,,lignin_cw_compound_1002,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1003,bmse010036,26468,1,,lignin_cw_compound_1003,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1004,bmse010037,26482,1,,lignin_cw_compound_1004,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1005,bmse010038,26499,1,,lignin_cw_compound_1005,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1006,bmse010039,26513,1,,lignin_cw_compound_1006,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_100,bmse010040,26527,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-1,3-diacetoxy-2-[4-(1-acetoxyethyl)phenoxy] propane",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Guaiacylglycerol-B-guaiacyl-ether,bmse010041,26547,1,,Guaiacylglycerol-B-guaiacyl ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Guaiacylglycerol-B-guaiacyl-ether,bmse010042,26567,1,,Guaiacylglycerol-B-guaiacyl ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetylated-acetovanillone,bmse010043,26587,1,,Acetylated acetovanillone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Veratrylglycerol-B-guaiacyl-ether,bmse010044,26607,1,,Veratrylglycerol-B-guaiacyl ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Veratrylglycerol-B-guaiacyl-ether,bmse010045,26627,1,,Veratrylglycerol-B-guaiacyl ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Erone,bmse010046,26647,1,,Erone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Vanillyl-B-D-Glucoside,bmse010047,26667,1,,Vanillyl-B-D-Glucoside,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetylated-ferulic-acid,bmse010048,26684,1,,Acetylated ferulic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pinoresinol-diacetate,bmse010049,26704,1,,Pinoresinol diacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Veratrone,bmse010050,26724,1,,Veratrone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylated-isoeugenol,bmse010051,26744,1,,acetylated isoeugenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Isoeugenol,bmse010052,26764,1,,Isoeugenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Eugenol,bmse010053,26784,1,,Eugenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010054,26804,1,,"4-Allyl-2,6-dimethoxyphenol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylated-eugenol,bmse010055,26824,1,,acetylated eugenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_116,bmse010056,26844,1,,"1-(3,5-dimethoxy-4-acetoxyphenyl)-2-propene",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringylresinol,bmse010057,26864,1,,Syringylresinol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Coniferin-acetate,bmse010058,26884,1,,Coniferin acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringin-acetate,bmse010059,26904,1,,Syringin acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringylresinol-diacetate,bmse010060,26924,1,,Syringylresinol diacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cis---Ferulic-Acid,bmse010061,26944,1,,cis - Ferulic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_125,bmse010062,26967,1,,1-(4-hydroxyphenyl)-2-phenoxyethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_126,bmse010063,26987,1,,lignin_cw_compound_126,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dihydrocoumaric-acid,bmse010064,27007,1,,Dihydrocoumaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylated-dihydrocoumaric-acid,bmse010065,27027,1,,acetylated dihydrocoumaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylated-coumaric-acid,bmse010066,27047,1,,acetylated coumaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_130,bmse010067,27067,1,,"2-acetoxy-1-(4-hydroxy-3,5-dimethoxyphenyl)propan-1-one",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_132,bmse010068,27087,1,,1-(4-hydroxy-3-methoxyphenyl)-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]ethanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_134,bmse010069,27107,1,,"1-(4-Hydroxy-3-methoxyphenyl)-2-[4-(1-hydroxyethyl)-2,6-dimethoxyphenoxy]propane-1,3-diol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_135,bmse010070,27127,1,,"3-(4-hydroxy-3-methoxyphenyl)-2-[4-(1-hydroxyethyl)-2,6-dimethoxyphenoxy]propan-1-ol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Vinyl-guaiacol,bmse010071,27147,1,,Vinyl guaiacol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_138,bmse010072,27167,1,,1-Acetoxy-1-(4-acetoxy-3-methoxyphenyl)2-[4-(1-acetoxyethyl)phenoxy] ethane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylated-coniferylaldehyde,bmse010073,27187,1,,acetylated coniferylaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylated-coniferyl-alcohol,bmse010074,27207,1,,acetylated coniferyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010075,27227,1,,"3,4-dimethoxybenzylacetate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,coniferaldehyde,bmse010076,27247,1,,coniferaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010077,27267,1,,"3,4-dimethoxycinnamyl alcohol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_146,bmse010078,27287,1,,"2-(4-Acetyl-2-methoxyphenoxy)-1-(3,4-dimethoxyphenyl)ethanone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_147,bmse010079,27307,1,,"1-(3,4-Dimethoxyphenyl)-2-(2-methoxyphenoxy)ethanol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl-4-acetoxycinnamate,bmse010080,27327,1,,methyl 4-acetoxycinnamate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylated-methyl-ferulate,bmse010081,27347,1,,acetylated methyl ferulate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010082,27367,1,,"3,4-dimethoxy cinnamaldehyde",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Coumaryl-alcohol,bmse010083,27387,1,,p-Coumaryl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Coumaraldehyde,bmse010084,27404,1,,p-Coumaraldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Sinapaldehyde,bmse010085,27421,1,,Sinapaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_154,bmse010086,27441,1,,1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)- ethanone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetylated-sinapaldehyde,bmse010087,27461,1,,Acetylated sinapaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010088,27481,1,,"3,4,5-Trimethoxyacetophenone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylated-p-gluco-cinnamic-acid,bmse010089,27501,1,,acetylated p-gluco cinnamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010090,27521,1,,"3,4-dimethoxycinnamyl acetate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Veratryl-glycerol,bmse010091,27541,1,,Veratryl glycerol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_161,bmse010092,27558,1,,"1-(3,4-dimethoxyphenyl)-2,3-dihydroxypropan-1-one",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Erone-diacetate,bmse010093,27575,1,,Erone diacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Veratrone-acetate,bmse010094,27592,1,,Veratrone acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pinoresinol-biphenyl,bmse010095,27612,1,,Pinoresinol biphenyl,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pinoresinol-biphenyl-acetate,bmse010096,27632,1,,Pinoresinol biphenyl acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ethyl-vanillin,bmse010097,27652,1,,Ethyl vanillin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phenylcoumaran-biphenyl-acetate,bmse010098,27669,1,,Phenylcoumaran biphenyl acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phenyl-coumaran-biphenyl,bmse010099,27689,1,,Phenyl coumaran biphenyl,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010100,27709,1,,"1,2-diguaiacylpropane-1,3-diol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-acetoxy-acetophenone,bmse010101,27729,1,,4-acetoxy-acetophenone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Vanillin-acetate,bmse010102,27749,1,,Vanillin acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringic-Acid-Acetate,bmse010103,27769,1,,Syringic Acid Acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Guaiacol-acetate,bmse010104,27789,1,,Guaiacol acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetosyringone-acetate,bmse010105,27809,1,,Acetosyringone acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Sinapic-acid-acetate,bmse010106,27829,1,,Sinapic acid acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-acetoxy-3-methoxy-methyl-benzoate,bmse010107,27849,1,,4-acetoxy-3-methoxy methyl benzoate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-S-c-CA,bmse010108,27869,1,,G-b-S-c-CA,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-S-c-CA-(acetate),bmse010109,27889,1,,G-b-S-c-CA (acetate),non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-S-r-S-(acetate),bmse010111,27929,1,,G-b-S-r-S (acetate),non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b-SA-(acetate),bmse010112,27949,1,,S-b-SA (acetate),non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b-CA-(acetate),bmse010113,27969,1,,S-b-CA (acetate),non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-c-CA-(acetate),bmse010114,27989,1,,S-c-CA (acetate),non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-SA-acetate,bmse010115,28009,1,,G-b-SA acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010116,28029,1,,"2,6-dimethoxyphenol acetate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phenol-acetate,bmse010117,28049,1,,phenol acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_191,bmse010118,28069,1,,"methyl (4-acetoxy-3,5-dimethoxy) benzoate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_192,bmse010119,28089,1,,4-acetoxy-3-methoxy benzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_193,bmse010120,28109,1,,S-b-S-b-SA (acetate),non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-S-r-S-b-G,bmse010121,28129,1,,G-b-S-r-S-b-G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_195,bmse010122,28149,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-1-acetoxy ethane",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_196,bmse010123,28169,1,,Acetylated Sinapic acid methyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-S-r-S-b-G-(acetate),bmse010124,28189,1,,G-b-S-r-S-b-G (acetate),non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b-S-r-S,bmse010125,28209,1,,S-b-S-r-S,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b-S-r-S-(acetate),bmse010126,28229,1,,S-b-S-r-S (acetate),non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Vanillyl-alcohol-diacetate,bmse010127,28249,1,,Vanillyl alcohol diacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringyl-alcohol-diacetate,bmse010128,28269,1,,Syringyl alcohol diacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_202,bmse010129,28289,1,,1-(4-acetoxy-3-methoxyphenyl)-1-acetoxyethane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-methoxy-benzaldehyde,bmse010130,28309,1,,4-methoxy benzaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_204,bmse010131,28329,1,,"1-(3,4-dimethoxyphenyl)-1-acetoxyethane",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_205,bmse010132,28349,1,,4-methoxybenzyl alcohol acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringaldehyde-acetate,bmse010133,28369,1,,Syringaldehyde acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Acetoxy-benzaldehyde,bmse010134,28389,1,,4-Acetoxy benzaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Acetoxy-benzoic-acid,bmse010135,28409,1,,4-Acetoxy benzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Methoxy-benzyl-alcohol,bmse010136,28429,1,,4-Methoxy benzyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_210,bmse010137,28449,1,,1-(4-acetoxyphenyl)-1-acetoxy ethane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Sinapyl-alcohol-diacetate,bmse010138,28469,1,,Sinapyl alcohol diacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_212,bmse010139,28489,1,,Syringylgycerol-B-vanillyl alcohol ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_213,bmse010140,28509,1,,Syringylgycerol-B-vanillyl alcohol ether tetra-acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_214,bmse010141,28529,1,,Guaiacylglycerol-B-guaiacyl ether acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Methoxy-cinnamaldehyde,bmse010142,28549,1,,p-Methoxy cinnamaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-G-c-CA-(acetate),bmse010143,28569,1,,G-b-G-c-CA (acetate),non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_217,bmse010144,28589,1,,"3-(4-hydroxy-3-methoxyphenyl)-2-[2,6-dimethoxyphenoxy]propan-1-ol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_218,bmse010145,28609,1,,"Acetic acid 3-(4-acetoxy-3-methoxyphenyl)-2-[2,6-dimethoxyphenoxy] propyl ester",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Methoxy-coumaryl-alcohol,bmse010146,28629,1,,p-Methoxy coumaryl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Methoxy-coumaryl-alcohol-acetate,bmse010147,28649,1,,p-Methoxy coumaryl alcohol acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,V-c-CA,bmse010148,28669,1,,V-c-CA,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Coumaryl-alcohol-acetate,bmse010149,28689,1,,Coumaryl alcohol acetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-acetoxy-cinnamaldehyde,bmse010150,28709,1,,4-acetoxy cinnamaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010151,28729,1,,"S-b-G-5,5-G-b-S (A = CH2)",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,H-b-S,bmse010152,28749,1,,H-b-S,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-bt-S-bt-G,bmse010153,28769,1,,G-bt-S-bt-G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b-S,bmse010154,28789,1,,S-b-S,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b-S,bmse010155,28809,1,,S-b-S,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cis-coniferyl-alcohol,bmse010156,28829,1,,cis-coniferyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-S,bmse010157,28849,1,,G-b-S,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b1-G,bmse010158,28869,1,,G-b1-G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-c-G,bmse010159,28889,1,,G-c-G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b-G-b1-G,bmse010160,28909,1,,S-b-G-b1-G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-a-G-b-G,bmse010161,28929,1,,G-a-G-b-G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,H-c-G,bmse010162,28949,1,,H-c-G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_246,bmse010163,28969,1,,lignin_cw_compound_246,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_247,bmse010164,28989,1,,lignin_cw_compound_247,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-S-b-S,bmse010165,29009,1,,G-b-S-b-S,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_251,bmse010166,29029,1,,lignin_cw_compound_251,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_253,bmse010167,29043,1,,lignin_cw_compound_253,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_255,bmse010168,29057,1,,lignin_cw_compound_255,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_256,bmse010169,29071,1,,lignin_cw_compound_256,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_257,bmse010170,29085,1,,lignin_cw_compound_257,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Vanillin-a-G-b-CA,bmse010171,29099,1,,Vanillin-a-G-b-CA,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_260,bmse010172,29116,1,,lignin_cw_compound_260,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b(t)-G-b(e)-S5,bmse010173,29136,1,,S-b(t)-G-b(e)-S5,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_264,bmse010174,29156,1,,"alpha,4-dihydroxy-3-methoxypropiophenone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_265,bmse010175,29176,1,,"alpha,4-diacetoxy-3-methoxypropiophenone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-a-S-b-S,bmse010176,29196,1,,S-a-S-b-S,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_267,bmse010177,29216,1,,lignin_cw_compound_267,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,H-b-H5e,bmse010178,29233,1,,H-b-H5e,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,H-b-H5t,bmse010179,29253,1,,H-b-H5t,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,H-b-H5e,bmse010180,29273,1,,H-b-H5e,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,H-b-H5t,bmse010181,29293,1,,H-b-H5t,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-5-O-4-G,bmse010182,29313,1,,G-5-O-4-G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-5-O-4-G-diacetate,bmse010183,29333,1,,G-5-O-4-G diacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_275,bmse010184,29353,1,,lignin_cw_compound_275,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_276,bmse010185,29373,1,,lignin_cw_compound_276,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dihydro-coniferyl-alcohol,bmse010186,29393,1,,dihydro-coniferyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_280,bmse010187,29413,1,,dihydro-coniferyl alcohol diacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_281,bmse010188,29433,1,,lignin_cw_compound_281,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_282,bmse010189,29453,1,,lignin_cw_compound_282,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,biphenyl-methane,bmse010190,29473,1,,biphenyl methane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_284,bmse010191,29493,1,,lignin_cw_compound_284,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_285,bmse010192,29513,1,,"A-(4-hydroxy-3,5-dimethoxyphenyl)-glycerol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_286,bmse010193,29533,1,,lignin_cw_compound_286,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_287,bmse010194,29553,1,,4-O-5,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_288,bmse010195,29573,1,,4-O-5,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_289,bmse010196,29593,1,,lignin_cw_compound_289,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_290,bmse010197,29613,1,,"1-(3,5-dimethoxy-4-hydroxy)-propanol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_291,bmse010198,29633,1,,lignin_cw_compound_291,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_292,bmse010199,29653,1,,"1-(3,4,5-trimethoxyphenyl)-1-propanol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_294,bmse010200,29673,1,,lignin_cw_compound_294,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_295,bmse010201,29693,1,,lignin_cw_compound_295,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_296,bmse010202,29713,1,,lignin_cw_compound_296,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringol,bmse010203,29733,1,,Syringol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringaldehyde,bmse010204,29753,1,,Syringaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Vanillic-acid,bmse010205,29773,1,,Vanillic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringic-acid,bmse010206,29793,1,,Syringic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Veratric-acid,bmse010207,29813,1,,Veratric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Coumaric-acid,bmse010208,29833,1,,p-Coumaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Sinapinic-acid,bmse010209,29850,1,,Sinapinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010210,29867,1,,"3,4-Dimethoxycinnamic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ferulic-acid,bmse010211,29887,1,,Ferulic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-Methoxycinnamic-acid,bmse010212,29907,1,,4-Methoxycinnamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_50,bmse010213,29927,1,,Syringylglycol-B-guaiacyl ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_51,bmse010214,29947,1,,"2-(4-Acetylphenoxy)-1-(3,4,5-trimethoxyphenyl)ethanone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_52,bmse010215,29967,1,,"2-(4-Acetyl-2-methoxyphenoxy)-1-(3,4,5-trimethoxyphenyl)ethanone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_53,bmse010216,29987,1,,"2-(4-Acetyl-2,6-dimethoxyphenoxy)-1-(3,4,5-trimethoxyphenyl)ethanone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010218,30027,1,,"1,2,3-trimethoxybenzene",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Veratrole,bmse010219,30047,1,,Veratrole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Veratraldehyde,bmse010220,30067,1,,Veratraldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methyl-Sinapate,bmse010221,30087,1,,Methyl Sinapate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methyl-p-Coumarate,bmse010222,30107,1,,Methyl p-Coumarate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010223,30127,1,,"methyl (3,4,5-trimethoxy)cinnamate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010224,30147,1,,"3,4,5-trimethoxy cinnamic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringic-acid-methyl-ester,bmse010225,30167,1,,Syringic acid methyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Vanillic-acid-methyl-ester,bmse010226,30187,1,,Vanillic acid methyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dihydrodehydrodiisoeugenol,bmse010227,30207,1,,Dihydrodehydrodiisoeugenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dehydrodiisoeugenol,bmse010228,30227,1,,Dehydrodiisoeugenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methyl-ferulate,bmse010229,30247,1,,Methyl ferulate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methylveratrate,bmse010230,30267,1,,Methylveratrate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010231,30287,1,,"methyl 3,4-dimethoxycinnamate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dehydrodiveratraldehyde,bmse010232,30307,1,,Dehydrodiveratraldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Dehydrodiveratric-acid,bmse010233,30327,1,,Dehydrodiveratric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_73,bmse010234,30341,1,,"2-(3,4-Dimethoxyphenyl)-7-methoxy-3-methyl-5-propyl-2,3-dihydrobenzofuran",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_74,bmse010235,30361,1,,Guaiacylglycerol-B-guaiacyl ether triacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_75,bmse010236,30381,1,,lignin_cw_compound_75,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_76,bmse010237,30401,1,,lignin_cw_compound_76,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_77,bmse010238,30421,1,,lignin_cw_compound_77,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_78,bmse010239,30441,1,,lignin_cw_compound_78,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_79,bmse010240,30461,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-2-(4-acetyl-2,6-dimethoxy phenoxy)-3-hydroxypropan-1-one",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_80,bmse010241,30481,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-2-(4-acetylphenoxy)-3-hydroxypropan-1-one",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_81,bmse010242,30501,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-2-(4-acetoxy-2-methoxyphenoxy)-3-hydroxypropan-1-one",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_82,bmse010243,30521,1,,4-Acetoxycinnamic acid 3-acetoxy-3-(4-acetoxy- 3-methoxyphenyl)-2-(2-methoxyphenoxy)propyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_83,bmse010244,30541,1,,4-Acetoxycinnamic acid 3-acetoxy-3-(4-acetoxy- 3-methoxyphenyl)-2-(2-methoxyphenoxy)propyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_84,bmse010245,30561,1,,"3-(4-Acetoxy-3-methoxyphenyl)acrylic acid 4-[1,3-diacetoxy-2-(2-methoxyphenoxy)propyl]phenyl ester",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_85,bmse010246,30581,1,,lignin_cw_compound_85,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_86,bmse010247,30601,1,,lignin_cw_compound_86,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Coniferyl-alcohol,bmse010248,30621,1,,Coniferyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_88,bmse010249,30641,1,,"1-(4-Hydroxy-3,5-dimethoxyphenyl)-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]propane-1,3-diol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_89,bmse010250,30661,1,,"1-(4-Hydroxy-3,5-dimethoxyphenyl)-2-[4-(1-hydroxyethyl)-2,6-dimethoxyphenoxy]propane-1,3-diol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringylglycerol-B-guaiacyl-ether,bmse010251,30681,1,,Syringylglycerol-B-guaiacyl ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_91,bmse010252,30701,1,,"1-(4-Hydroxy-3,5-dimethoxyphenyl)-2-[4-(1-hydroxyethyl)phenoxy]propane-1,3-diol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_92,bmse010253,30721,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-3-hydroxy-2-(2-methoxyphenoxy)propan-1-one",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phenyl-benzoate,bmse010254,30741,1,,Phenyl benzoate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Ethyl-4-hydroxybenzoate,bmse010255,30761,1,,Ethyl 4-hydroxybenzoate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Cinnamyl-alcohol,bmse010256,30781,1,,Cinnamyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Cinnamaldehyde,bmse010257,30801,1,,Cinnamaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_97,bmse010258,30821,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-1,3-diacetoxy-2-[4-(1-acetoxyethyl)-2-methoxyphenoxy]",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_98,bmse010259,30841,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-1,3-diacetoxy-2-[4-(1-acetoxyethyl)-2,6-dimethoxyphenoxy]propane",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_99,bmse010260,30861,1,,"1-(4-acetoxy-3,5-dimethoxyphenyl)-1,3-diacetoxy-2-(2-methoxyphenoxy)propane",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1007,bmse010261,30881,1,,lignin_cw_compound_1007,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1008,bmse010262,30895,1,,lignin_cw_compound_1008,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1009,bmse010263,30909,1,,lignin_cw_compound_1009,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1010,bmse010264,30923,1,,lignin_cw_compound_1010,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1011,bmse010265,30937,1,,lignin_cw_compound_1011,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1012,bmse010266,30951,1,,lignin_cw_compound_1012,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1013,bmse010267,30965,1,,lignin_cw_compound_1013,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1014,bmse010268,30979,1,,lignin_cw_compound_1014,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1015,bmse010269,30993,1,,lignin_cw_compound_1015,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1016,bmse010270,31007,1,,lignin_cw_compound_1016,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1017,bmse010271,31021,1,,lignin_cw_compound_1017,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1018,bmse010272,31035,1,,lignin_cw_compound_1018,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1019,bmse010273,31049,1,,lignin_cw_compound_1019,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1020,bmse010274,31063,1,,lignin_cw_compound_1020,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1021,bmse010275,31077,1,,lignin_cw_compound_1021,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1022,bmse010276,31091,1,,lignin_cw_compound_1022,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1023,bmse010277,31105,1,,"3-(4-acetoxyphenyl) acrylic acid 4-[1,3-diacetoxy-2- (2-methoxyphenoxy) propyl] phenyl ester",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1024,bmse010278,31119,1,,"3-(4-acetoxyphenyl) acrylic acid 4-[1,3-diacetoxy-2- (2-methoxyphenoxy) propyl] phenyl ester",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1025,bmse010279,31133,1,,lignin_cw_compound_1025,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1026,bmse010280,31147,1,,lignin_cw_compound_1026,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1027,bmse010281,31161,1,,Acetic acid 2-methoxy-4-[2-(2-methoxyphenoxy) acetyl] phenyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1028,bmse010282,31175,1,,Acetic acid 4-[3-hydroxy-2-(2-methoxyphenoxy) propionyl]-2-methoxyphenyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1029,bmse010283,31189,1,,Acetic acid 3-acetoxy-3-(4-hydroxy-3-methoxyphenyl) -2-(2-methoxyphenoxy) propyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_1030,bmse010284,31203,1,,Acetic acid 3-acetoxy-3-(4-hydroxy-3-methoxyphenyl) -2-(2-methoxyphenoxy) propyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,coniferyl-alcohol,bmse010285,31217,1,,coniferyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,sinapyl-alcohol,bmse010286,31237,1,,sinapyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-coumaryl-alcohol,bmse010287,31257,1,,p-coumaryl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2005,bmse010288,31277,1,,lignin_cw_compound_2005,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2006,bmse010289,31297,1,,lignin_cw_compound_2006,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2008,bmse010290,31317,1,,dilactone from ferulic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,coniferyl-p-coumarate,bmse010291,31337,1,,coniferyl p-coumarate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2011,bmse010292,31357,1,,Guaiacylglycerol-B-coniferyl ether peracetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2012,bmse010293,31377,1,,Guaiacyl glycerol-B-coniferyl ether peracetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2015,bmse010294,31397,1,,"Guaiacylglycerol-A,B-bis-coniferyl ether",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2016,bmse010295,31417,1,,lignin_cw_compound_2016,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2018,bmse010296,31437,1,,beta-5-dehydrodiferulic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pinoresinol,bmse010297,31457,1,,Pinoresinol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2022,bmse010298,31477,1,,"Guaiacylglycerol-A,B-bis coniferyl ether acetate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2026,bmse010299,31497,1,,lignin_cw_compound_2026,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2031,bmse010300,31517,1,,"4,4?-dihydroxy-3,3?-dimethoxy-B,B?-bicinnamic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2032,bmse010301,31534,1,,"G?-methoxy-4,4?-dihydroxy-3,3?-dimethoxy-B,B?-bicinnamic acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2035,bmse010302,31548,1,,lignin_cw_compound_2035,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2036,bmse010303,31568,1,,B-B-coupled dehydrodiferulic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2038,bmse010304,31585,1,,4-0-5-coupled dehydrodivanillin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2040,bmse010305,31605,1,,lignin_cw_compound_2040,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2041,bmse010306,31622,1,,lignin_cw_compound_2041,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2042,bmse010307,31642,1,,lignin_cw_compound_2042,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2043,bmse010308,31662,1,,lignin_cw_compound_2043,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2049,bmse010309,31679,1,,lignin_cw_compound_2049,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2050,bmse010310,31693,1,,lignin_cw_compound_2050,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2052,bmse010311,31713,1,,lignin_cw_compound_2052,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2053,bmse010312,31727,1,,lignin_cw_compound_2053,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_cysteine,bmst000265,36182,1,,L-cysteine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2057,bmse010313,31741,1,,5-5 Dehydrodiferulate diethyl ester,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2058,bmse010314,31761,1,,"5,5 Dehydrodiconiferyl Alcohol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2062,bmse010315,31775,1,,lignin_cw_compound_2062,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2063,bmse010316,31789,1,,Dihydroconiferyl 4-hydroxydihydrocinnamate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2064,bmse010317,31809,1,,Dihydrosinapyl dihydro-p-coumarate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Sinapyl-p-coumarate,bmse010318,31829,1,,Sinapyl p-coumarate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2066,bmse010319,31849,1,,"2-(4-Acetoxy-3,5-dimethoxybenzoyl)-2-(2-methoxyphenoxy)ethyl 4-acetoxycinnamate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2067,bmse010320,31869,1,,"1(4-acetoxy-3,5-dimethoxyphenyl)-3-hydroxy-2-(2-methoxyphenoxy)propanone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2068,bmse010321,31883,1,,lignin_cw_compound_2068,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Seco-isolariciresinol,bmse010322,31897,1,,Seco-isolariciresinol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2071,bmse010323,31911,1,,lignin_cw_compound_2071,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2072,bmse010324,31931,1,,lignin_cw_compound_2072,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2073,bmse010325,31951,1,,lignin_cw_compound_2073,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2074,bmse010326,31971,1,,lignin_cw_compound_2074,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2079,bmse010327,31991,1,,lignin_cw_compound_2079,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2080,bmse010328,32005,1,,lignin_cw_compound_2080,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2081,bmse010329,32019,1,,lignin_cw_compound_2081,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3001,bmse010330,32039,1,,4-O-5 dehydrodiethylferulate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3002,bmse010331,32053,1,,lignin_cw_compound_3002,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3003,bmse010332,32067,1,,4-O-5 dehydrodiferulic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3004,bmse010333,32084,1,,"1,2-diguaiacylpropane-1,3-diol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3005,bmse010334,32098,1,,"Acetic acid3-acetoxy-2,3-bis-(4-acetoxy-3-methoxyphenyl)propyl ester",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3006,bmse010335,32112,1,,"Acetic acid3-acetoxy-2,3-bis-(4-acetoxy-3-methoxyphenyl)propyl ester",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3008,bmse010336,32126,1,,lignin_cw_compound_3008,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3010,bmse010337,32140,1,,lignin_cw_compound_3010,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3011,bmse010338,32157,1,,lignin_cw_compound_3011,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3014,bmse010339,32174,1,,"4-(4-hydroxy-3-methoxyphenyl)-7-methoxy-1,3,3a,4,9,9a-hexahydronaphtho[2,3-c]furan-1,6-diol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3015,bmse010340,32188,1,,"4-(4-hydroxy-3-methoxyphenyl)-7-methoxy-1,3,3a,4,9,9a-hexahydronaphtho[2,3-c]furan-1,6-diol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3016,bmse010341,32202,1,,lignin_cw_compound_3016,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3017,bmse010342,32219,1,,"6-Hydroxy-4-(4-hydroxy-3-methoxyphenyl)-7-methoxy-3a,4,9,9a-tetrahydro-3H-naphtho[2,3-c]furan-1-one",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3018,bmse010343,32233,1,,lignin_cw_compound_3018,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3019,bmse010344,32250,1,,lignin_cw_compound_3019,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3020,bmse010345,32270,1,,lignin_cw_compound_3020,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3021,bmse010346,32284,1,,lignin_cw_compound_3021,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3022,bmse010347,32298,1,,lignin_cw_compound_3022,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3023,bmse010348,32318,1,,lignin_cw_compound_3023,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3025,bmse010349,32332,1,,3-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxy-4-propylphenoxy)propan-1-ol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3026,bmse010350,32352,1,,"2-(2,6-dimethoxy-4-propylphenoxy)-3-(4-hydroxy-3-methoxyphenyl)propan-1-ol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3027,bmse010351,32372,1,,"3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(2-methoxy-4-propylphenoxy)propan-1-ol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3028,bmse010352,32392,1,,"3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(2,5-dimethoxy-4-propylphenoxy)propan-1-ol",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3031,bmse010353,32412,1,,beta-[4-(2-formylvinyl)-2-methoxyphenoxy] coniferyl aldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3033,bmse010354,32426,1,,"5,5'-bis-coniferyl aldehyde",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3034,bmse010355,32440,1,,lignin_cw_compound_3034,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3035,bmse010356,32454,1,,lignin_cw_compound_3035,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3036,bmse010357,32468,1,,lignin_cw_compound_3036,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3037,bmse010358,32482,1,,lignin_cw_compound_3037,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3039,bmse010359,32496,1,,lignin_cw_compound_3039,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3040,bmse010360,32510,1,,lignin_cw_compound_3040,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3041,bmse010361,32524,1,,lignin_cw_compound_3041,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3042,bmse010362,32538,1,,lignin_cw_compound_3042,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3043,bmse010363,32552,1,,lignin_cw_compound_3043,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3044,bmse010364,32566,1,,lignin_cw_compound_3044,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3045,bmse010365,32580,1,,lignin_cw_compound_3045,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3046,bmse010366,32597,1,,lignin_cw_compound_3046,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3047,bmse010367,32611,1,,lignin_cw_compound_3047,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,6-methoxy-indan-5-ol,bmse010368,32625,1,,6-methoxy-indan-5-ol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3052,bmse010369,32639,1,,lignin_cw_compound_3052,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3053,bmse010370,32653,1,,lignin_cw_compound_3053,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3056,bmse010371,32667,1,,lignin_cw_compound_3056,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3058,bmse010372,32681,1,,lignin_cw_compound_3058,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3059,bmse010373,32695,1,,lignin_cw_compound_3059,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3061,bmse010374,32709,1,,lignin_cw_compound_3061,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3062,bmse010375,32723,1,,lignin_cw_compound_3062,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Simulanol,bmse010376,32737,1,,Simulanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,buddlenol-E,bmse010377,32751,1,,buddlenol E,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,buddlenol-A,bmse010378,32765,1,,buddlenol A,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,SP-(8-8)-S,bmse010379,32779,1,,SP-(8-8)-S,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-(8-O-4)-S,bmse010380,32793,1,,G-(8-O-4)-S,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3068,bmse010381,32807,1,,nocomtal,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3069,bmse010382,32821,1,,nocomtal,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3070,bmse010383,32835,1,,G-(8-O-4)-5H??,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3071,bmse010384,32849,1,,lignin_cw_compound_3071,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3,bmse010385,32863,1,,lignin_cw_compound_3,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_21,bmse010386,32883,1,,lignin_cw_compound_21,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_31,bmse010387,32903,1,,lignin_cw_compound_31,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_32,bmse010388,32923,1,,lignin_cw_compound_32,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_33,bmse010389,32943,1,,lignin_cw_compound_33,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_34,bmse010390,32963,1,,lignin_cw_compound_34,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4-hydroxybenzoic-acid,bmse010395,32983,1,,4-hydroxybenzoic-acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl-(4-methoxy)cinnamate,bmse010396,33000,1,,methyl-(4-methoxy)cinnamate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Coniferin,bmse010420,33020,1,,Coniferin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Syringin,bmse010421,33034,1,,Syringin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity_1,bmse010422,33048,1,,"alpha,beta-Xylose-Acetate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_131,bmse010423,33068,1,,lignin_cw_compound_131,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_133,bmse010424,33088,1,,lignin_cw_compound_133,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_137,bmse010425,33108,1,,lignin_cw_compound_137,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-beta-S5,bmse010426,33128,1,,G-beta-S5,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_140,bmse010427,33148,1,,lignin_cw_compound_140,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,p-Gluco-cinnamyl-alcohol,bmse010428,33168,1,,p-Gluco-cinnamyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_172,bmse010430,33182,1,,lignin_cw_compound_172,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-G-AcO,bmse010432,33202,1,,G-b-G-AcO,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b-S-AcO,bmse010433,33222,1,,S-b-S-AcO,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-G-b1-G,bmse010434,33242,1,,G-b-G-b1-G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,H-b-G-AcO,bmse010435,33262,1,,H-b-G-AcO,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_240,bmse010436,33282,1,,lignin_cw_compound_240,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,H-b-G-OH,bmse010437,33302,1,,H-b-G-OH,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_242,bmse010438,33322,1,,lignin_cw_compound_242,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b-S-OH,bmse010439,33342,1,,S-b-S-OH,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-H,bmse010440,33362,1,,G-b-H,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,G-b-G-OH,bmse010441,33382,1,,G-b-G-OH,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,H-b-S-OH,bmse010442,33402,1,,H-b-S-OH,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_252,bmse010443,33422,1,,lignin_cw_compound_252,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_254,bmse010444,33436,1,,lignin_cw_compound_254,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dihydrodiconiferyl-alcohol,bmse010445,33450,1,,dihydrodiconiferyl-alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_262,bmse010446,33470,1,,lignin_cw_compound_262,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_263,bmse010447,33487,1,,lignin_cw_compound_263,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_272,bmse010448,33501,1,,lignin_cw_compound_272,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dibenzodioxicin,bmse010449,33521,1,,dibenzodioxicin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_278,bmse010450,33541,1,,lignin_cw_compound_278,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_293,bmse010451,33561,1,,lignin_cw_compound_293,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Veratryl_alcohol_methyl_ether,bmse010452,33581,1,,Veratryl_alcohol_methyl_ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methoxy_hydroxy_stilbene_carboxylic_acid,bmse010453,33601,1,,Methoxy_hydroxy_stilbene_carboxylic_acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_299,bmse010454,33621,1,,lignin_cw_compound_299,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5_O_4_diacetovanillone,bmse010455,33641,1,,5_O_4_diacetovanillone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,guaiacyl_chalcone,bmse010456,33661,1,,guaiacyl_chalcone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,345_trimethoxy_cinnamyl_alcohol,bmse010457,33681,1,,345_trimethoxy_cinnamyl_alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2004,bmse010458,33701,1,,lignin_cw_compound_2004,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2007,bmse010459,33721,1,,lignin_cw_compound_2007,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,coniferyl-benzoate,bmse010460,33741,1,,coniferyl-benzoate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Guaiacylglycerol-B-coniferyl-ether,bmse010461,33761,1,,Guaiacylglycerol-B-coniferyl-ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Guaiacylglycerol-B-coniferyl-ether,bmse010462,33781,1,,Guaiacylglycerol-B-coniferyl-ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2017,bmse010463,33801,1,,lignin_cw_compound_2017,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2019,bmse010464,33818,1,,lignin_cw_compound_2019,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2021,bmse010465,33838,1,,lignin_cw_compound_2021,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2023,bmse010466,33852,1,,lignin_cw_compound_2023,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2024,bmse010467,33872,1,,lignin_cw_compound_2024,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2025,bmse010468,33892,1,,lignin_cw_compound_2025,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2027,bmse010469,33906,1,,lignin_cw_compound_2027,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2028,bmse010470,33926,1,,lignin_cw_compound_2028,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2029,bmse010471,33943,1,,lignin_cw_compound_2029,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2030,bmse010472,33963,1,,lignin_cw_compound_2030,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2033,bmse010473,33983,1,,lignin_cw_compound_2033,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2034,bmse010474,34000,1,,lignin_cw_compound_2034,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2037,bmse010475,34020,1,,lignin_cw_compound_2037,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2039,bmse010476,34034,1,,lignin_cw_compound_2039,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2044,bmse010477,34054,1,,lignin_cw_compound_2044,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2045,bmse010478,34071,1,,lignin_cw_compound_2045,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2046,bmse010479,34085,1,,lignin_cw_compound_2046,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2047,bmse010480,34099,1,,lignin_cw_compound_2047,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2048,bmse010481,34113,1,,lignin_cw_compound_2048,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2051,bmse010483,34127,1,,lignin_cw_compound_2051,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2054,bmse010484,34141,1,,lignin_cw_compound_2054,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2055,bmse010485,34158,1,,lignin_cw_compound_2055,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5_5_Dehydrodiferulic_Acid,bmse010486,34172,1,,"5-5, Dehydrodiferulic Acid",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2059,bmse010487,34189,1,,lignin_cw_compound_2059,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2060,bmse010488,34209,1,,lignin_cw_compound_2060,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2061,bmse010489,34229,1,,lignin_cw_compound_2061,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Isotaxiresinol,bmse010490,34249,1,,Isotaxiresinol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2075,bmse010492,34263,1,,lignin_cw_compound_2075,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2076,bmse010493,34280,1,,lignin_cw_compound_2076,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2077,bmse010494,34300,1,,lignin_cw_compound_2077,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2078,bmse010495,34320,1,,lignin_cw_compound_2078,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_2082,bmse010496,34340,1,,lignin_cw_compound_2082,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3007,bmse010497,34354,1,,lignin_cw_compound_3007,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3009,bmse010498,34371,1,,lignin_cw_compound_3009,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3013,bmse010499,34385,1,,lignin_cw_compound_3013,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3024,bmse010502,34399,1,,lignin_cw_compound_3024,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3029,bmse010504,34413,1,,lignin_cw_compound_3029,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3030,bmse010505,34427,1,,lignin_cw_compound_3030,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3032,bmse010506,34441,1,,lignin_cw_compound_3032,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3038,bmse010507,34455,1,,lignin_cw_compound_3038,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3049,bmse010508,34469,1,,lignin_cw_compound_3049,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3050,bmse010509,34483,1,,lignin_cw_compound_3050,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3051,bmse010510,34497,1,,lignin_cw_compound_3051,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3054,bmse010511,34511,1,,lignin_cw_compound_3054,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3055,bmse010512,34525,1,,lignin_cw_compound_3055,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3057,bmse010514,34539,1,,lignin_cw_compound_3057,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3060,bmse010515,34553,1,,lignin_cw_compound_3060,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S_8_O_4_G_8_5_G,bmse010516,34567,1,,S_8_O_4_G_8_5_G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_3012,bmse010517,34581,1,,lignin_cw_compound_3012,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_166,bmse010518,34595,1,,lignin_cw_compound_166,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,lignin_cw_compound_168,bmse010519,34609,1,,lignin_cw_compound_168,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Guaiacylglycerol_B_syringyl_ether,bmse010520,34626,1,,Guaiacylglycerol-B-syringyl ether,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S-b-G,bmse010521,34644,1,,S-b-G,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmse500001,34663,1,,Androstenedione,non-polymer,,,,,,,,,,,,no,,,,,,,no,not reported,,,,,,,,,,,,
entity,1_3_diaminopropane,bmst000001,34675,1,,1-3-diaminopropane,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_deoxyguanosine,bmst000002,34685,1,,2'-Deoxyguanosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adenine,bmst000007,34695,1,,adenine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adenosine,bmst000008,34705,1,,adenosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,adonitol,bmst000009,34715,1,,adonitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ADP,bmst000010,34725,1,,ADP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_lactose,bmst000019,34735,1,,alpha-lactose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,AMP,bmst000022,34745,1,,AMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,anthranilic_acid,bmst000023,34755,1,,anthranilic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ATP,bmst000033,34765,1,,ATP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,betaine,bmst000039,34775,1,,betaine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cadaverine,bmst000051,34785,1,,"1,5-Diaminopentane",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cAMP,bmst000052,34795,1,,cyclic AMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,chorismic_acid,bmst000056,34805,1,,chorismic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,citrate,bmst000057,34815,1,,citrate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,coumarin,bmst000058,34825,1,,coumarin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,creatine,bmst000059,34835,1,,creatine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dehydro_proline,bmst000063,34845,1,,"3,4-dehydro-d/L-proline",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,fumaric_acid,bmst000074,34855,1,,sodium fumarate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,gluconic_acid,bmst000076,34865,1,,gluconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycine,bmst000084,34875,1,,glycine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,guanine,bmst000086,34885,1,,guanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,guanosine,bmst000087,34894,1,,guanosine,non-polymer,,,,,,,,,,N,N,no,N,N,,,,,no,not reported,,,,,,,,,,,,
entity,4_hydroxybenzoic_acid,bmst000089,34904,1,,4-hydroxy-benzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_hydroxycinnamic_acid,bmst000090,34914,1,,4-Hydroxycinnamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,hypoxanthine,bmst000091,34924,1,,hypoxanthine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,i_erythritol,bmst000092,34934,1,,i-erythritol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,imidazole,bmst000093,34944,1,,imidazole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,indole,bmst000094,34954,1,,indole,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,inosine,bmst000095,34964,1,,inosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_citrulline,bmst000097,34974,1,,L-citrulline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_cystathionine,bmst000098,34984,1,,L-cystathionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_homoserine,bmst000101,34994,1,,L-homoserine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,meso_erythritol,bmst000105,35004,1,,meso-erythritol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,muco_inositol,bmst000108,35014,1,,muco-inositol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,myo_inositol,bmst000109,35024,1,,myo-inositol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_D_mannosamine,bmst000110,35034,1,,N-Acetyl-D-mannosamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,NAD,bmst000112,35044,1,,NAD,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,NADH,bmst000113,35054,1,,NADH,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,NADPH,bmst000114,35064,1,,NADPH,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,niacin,bmst000115,35074,1,,nicotinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,nicotine,bmst000117,35084,1,,(+/-) nicotine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,O_succinyl_L_homoserine,bmst000119,35094,1,,O-succinyl-L-homoserine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,prephenic_acid,bmst000123,35104,1,,prephenic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,putrescine,bmst000125,35114,1,,"putrescine (1,4 diaminobutane)",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,pyridoxal,bmst000126,35124,1,,pyridoxal,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,pyridoxal_5_phosphate,bmst000127,35134,1,,pyridoxal-5-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S_adenosyl_L_methionine,bmst000131,35144,1,,s-(5'-adenosyl)-L-methionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,xanthine,bmst000151,35154,1,,xanthine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1_3_dimethylurea,bmst000154,35164,1,,"1,3-Dimethylurea",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_amino_5_ethyl_1_3_4_thiadiazole,bmst000156,35174,1,,"2-Amino-5-ethyl-1,3,4-thiadiazole",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,2_deoxyguanosine_5_triphosphate,bmst000158,35183,1,,2'-Deoxyguanosine 5'-triphosphate,non-polymer,,,,,,,,,,N,N,no,N,N,,,,,no,not reported,,,,,,,,,,,,
entity,3_hydroxybutyrate,bmst000159,35193,1,,3-hydroxybutyrate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_2_aminoethyl_morpholine,bmst000160,35203,1,,4-(2-Aminoethyl)morpholine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_aminoantipyrine,bmst000161,35213,1,,4-Aminoantipyrine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_aminobenzoic_acid,bmst000162,35223,1,,4-aminobenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_hydroxyphenethyl_alcohol,bmst000163,35233,1,,4-Hydroxyphenethyl alcohol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5_acetylamido_2_chloroaniline,bmst000164,35243,1,,5-Acetylamido-2-chloroaniline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,6_phosphogluconic_acid,bmst000165,35253,1,,6-Phosphogluconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ADA,bmst000166,35263,1,,N-(2-Acetamido)iminodiacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL_alpha_glycerol_phosphate,bmst000167,35273,1,,DL-alpha-Glycerol phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL_pipecolic_acid,bmst000168,35283,1,,DL-pipecolic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL_serine,bmst000169,35293,1,,DL-Serine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_3_phosphoglyceric_acid,bmst000170,35303,1,,D-(-)-3-phosphoglyceric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_L_glyceraldehyde,bmst000171,35313,1,,"D,L-Glyceraldehyde",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_alanine,bmst000172,35323,1,,D-Alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_carnitine,bmst000173,35333,1,,D-Carnitine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_cellobiose,bmst000174,35343,1,,D-cellobiose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_citrulline,bmst000175,35353,1,,D-Citrulline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_galacturonic_acid,bmst000177,35363,1,,D-Galacturonic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucosamine_6_phosphate,bmst000178,35373,1,,D-Glucosamine 6-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_ribose_5_phosphate,bmst000180,35383,1,,D-Ribose 5-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_saccharate,bmst000182,35393,1,,D-Saccharate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_xylonate_cadmium,bmst000183,35403,1,,D-Xylonate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,HEPES,bmst000184,35413,1,,HEPES,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L-ascorbate,bmst000185,35423,1,,(+)-Sodium L-ascorbate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arginine_L_glutamate,bmst000186,35433,1,,L-Arginine L-Glutamate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_carnosine,bmst000187,35443,1,,L-carnosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutathione_oxidized,bmst000188,35453,1,,"L(-)-Glutathione, oxidized",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutathione_reduced,bmst000189,35463,1,,L-Glutathione reduced,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_gulonolactone,bmst000190,35473,1,,L-Gulonolactone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_kynurenine,bmst000191,35483,1,,L-Kynurenine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_lactic_acid,bmst000192,35493,1,,L-(+) lactic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_ornithine,bmst000194,35503,1,,L-Ornithine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_selenomethionine,bmst000195,35513,1,,L(+)-Selenomethionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_tartaric_acid,bmst000196,35523,1,,L-Tartaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_N_dimethylglycine,bmst000197,35533,1,,"N,N-Dimethylglycine",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_D_glucosamine,bmst000198,35543,1,,N-acetyl-D-glucosamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_D_glucosamine_1_phosphate,bmst000199,35553,1,,N-Acetyl-alpha-D-glucosamine 1-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_D_glucosamine_6_phosphate,bmst000200,35563,1,,N-Acetyl-D-glucosamine 6-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_L_alanine,bmst000201,35573,1,,N-Acetyl-L-Alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetyl_L_glutamine,bmst000202,35583,1,,N-acetyl-L-Glutamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_alpha_acetyl_DL_ornithine,bmst000203,35593,1,,N(alpha)-Acetyl-DL-Ornithine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetic_acid,bmst000204,35603,1,,Acetic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,acetylcarnitine,bmst000206,35613,1,,(+-)-Acetylcarnitine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,1_amino_1_phenylmethyl_phosphonic_acid,bmst000208,35623,1,,(1-amino-1-phenylmethyl)phosphonic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,3_4_Hydroxyphenyl_pyruvate,bmst000209,35633,1,,3-(4-Hydroxyphenyl)pyruvate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_Hydroxybenzaldehyde,bmst000210,35643,1,,4-Hydroxybenzaldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_Nitrocatechol,bmst000211,35653,1,,4-Nitrocatechol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_Nitrophenyl_phosphate,bmst000212,35663,1,,4-Nitrophenyl phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,4_nitrophenol,bmst000213,35673,1,,4-Nitrophenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,5_acetylamino_2_nitrobenzoic_acid,bmst000214,35683,1,,5-(acetylamino)-2-nitrobenzoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetophenone,bmst000215,35693,1,,Acetophenone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Acetyl_phosphate,bmst000216,35703,1,,Acetyl phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Benzoate,bmst000217,35713,1,,Benzoate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Benzonitrile,bmst000218,35723,1,,Benzonitrile,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,CDP,bmst000219,35733,1,,CDP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,CTP,bmst000220,35743,1,,CTP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Choline,bmst000221,35753,1,,Choline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,CoA,bmst000222,35763,1,,CoA,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,DL_Alanine,bmst000223,35773,1,,Alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_Aspartate,bmst000224,35783,1,,D-Aspartate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_Fructose_1_phosphate,bmst000225,35793,1,,D-Fructose 1-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_Fructose_2_6_bisphosphate,bmst000226,35803,1,,"D-Fructose 2,6-bisphosphate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_Glyceraldehyde,bmst000227,35813,1,,D-Glyceraldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,entity,bmst000228,35822,1,,D-Ribulose 5-phosphate,non-polymer,,,,,,,,,,no,no,,no,no,,,,,,,,,,,,,,,,,,
entity,caffeine,bmst000229,35832,1,,Caffeine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UDPglucuronate,bmst000230,35842,1,,UDPglucuronate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dADP,bmst000231,35852,1,,dADP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dTMP,bmst000232,35862,1,,dTMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,FMN,bmst000233,35872,1,,FMN,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UDP,bmst000234,35882,1,,UDP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dAMP,bmst000235,35892,1,,dAMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,uridine,bmst000236,35902,1,,Uridine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cytidine,bmst000237,35912,1,,Cytidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,uracil,bmst000238,35922,1,,Uracil,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UTP,bmst000239,35932,1,,UTP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,uridine_5_diphospho_N_acetlyglucosamine,bmst000241,35942,1,,Uridine 5'-Diphospho-N-Acetlyglucosamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Thiamin,bmst000242,35952,1,,Thiamin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cytosine,bmst000243,35962,1,,Cytosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UMP,bmst000244,35972,1,,UMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,inosine_5_monophosphate,bmst000245,35982,1,,Inosine 5'-monophosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucuronate,bmst000246,35992,1,,D-Glucuronate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,D_glucuronate,bmst000247,36002,1,,D-Glucuronate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_valine,bmst000248,36012,1,,L-valine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_tyrosine,bmst000249,36022,1,,L-tyrosine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_tryptophan,bmst000250,36032,1,,L-tryptophan,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_threonine,bmst000251,36042,1,,L-threonine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_threitol,bmst000252,36052,1,,L-(-)-threitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_serine,bmst000253,36062,1,,L-serine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_proline,bmst000254,36072,1,,L-proline,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_phenylalanine,bmst000255,36082,1,,L-phenylalanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_methionine,bmst000256,36092,1,,L-methionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_malic_acid,bmst000257,36102,1,,L-malic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_lysine,bmst000258,36112,1,,L-lysine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_leucine,bmst000259,36122,1,,L-leucine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_isoleucine,bmst000260,36132,1,,L-isoleucine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_histidine,bmst000261,36142,1,,L-histidine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutamine,bmst000262,36152,1,,L-glutamine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_glutamic_acid,bmst000263,36162,1,,L-glutamic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_cystine,bmst000264,36172,1,,L-cystine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_carnitine,bmst000266,36192,1,,L(-)-Carnitine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_canavanine,bmst000267,36202,1,,L-Canavanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_aspartic_acid,bmst000268,36212,1,,L-aspartic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_asparagine,bmst000269,36222,1,,L-asparagine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arginine,bmst000270,36232,1,,L-arginine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_arabitol,bmst000271,36242,1,,L-(-) arabitol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,L_alanine,bmst000272,36252,1,,L-alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ITP,bmst000273,36262,1,,ITP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Hydroquinone,bmst000274,36272,1,,Hydroquinone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Methanol,bmst000275,36282,1,,Methanol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,N_acetylneuraminic_acid,bmst000276,36292,1,,N-Acetylneuraminic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Nicotinamide,bmst000277,36302,1,,Nicotinamide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Orotate,bmst000278,36312,1,,Orotate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Oxalosuccinate,bmst000279,36322,1,,Oxalosuccinate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pantothenate,bmst000280,36332,1,,Pantothenate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Phenol,bmst000281,36342,1,,Phenol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Pyridoxine,bmst000282,36352,1,,Pyridoxine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,R_Lactate,bmst000283,36362,1,,(R)-Lactate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S_Adenosyl_L_homocysteine,bmst000284,36372,1,,S-Adenosyl-L-homocysteine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,S_adenosyl_L_methionine,bmst000285,36382,1,,s-(5'-adenosyl)-L-methionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Salicylate,bmst000286,36392,1,,Salicylate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Selenomethionine,bmst000287,36402,1,,Selenomethionine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Thiamin,bmst000288,36412,1,,Thiamin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UDP,bmst000289,36422,1,,UDP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UDPglucuronate,bmst000290,36432,1,,UDPglucuronate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UMP,bmst000291,36442,1,,UMP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,UTP,bmst000292,36452,1,,UTP,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,Urocanate,bmst000293,36462,1,,Urocanate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,agmatine,bmst000294,36472,1,,agmatine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_D_galactose_1_phosphate,bmst000295,36482,1,,alpha-D-Galactose 1-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_D_glucose_1_6_bisphosphate,bmst000296,36492,1,,"alpha-D-Glucose 1,6-bisphosphate",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_D_glucose_1_phosphate,bmst000297,36502,1,,alpha-d-glucose-1-phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_ketoglutaric_acid,bmst000298,36512,1,,alpha-ketoglutaric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,alpha_naphthoic_acid,bmst000299,36522,1,,alpha-naphthoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,amygdalin,bmst000300,36532,1,,Amygdalin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,beta_alanine,bmst000301,36542,1,,beta-alanine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,betaine_aldehyde,bmst000302,36552,1,,Betaine aldehyde,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,biotin,bmst000303,36562,1,,(+)-Biotin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,citraconic_acid,bmst000304,36572,1,,citraconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,creatine_phosphate,bmst000305,36582,1,,creatine phosphate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,creatinine,bmst000306,36592,1,,Creatinine,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,cyanuric_acid,bmst000307,36602,1,,cyanuric acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,diethyl_oxalacetate,bmst000308,36612,1,,Diethyl oxalacetate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,dihydroxyacetone,bmst000309,36622,1,,Dihydroxyacetone,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,ethacrynic_acid,bmst000310,36632,1,,ethacrynic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,formate,bmst000311,36642,1,,Sodium Formate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,gamma_D_galactonolactone,bmst000312,36652,1,,"D-Galactono-1,4-lactone",non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycerol,bmst000313,36662,1,,Glycerol,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycogen,bmst000314,36672,1,,Glycogen,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,glycolate,bmst000315,36682,1,,Sodium glycolate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,homogentisic_acid,bmst000316,36692,1,,homogentisic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,homovanillic_acid,bmst000317,36702,1,,homovanillic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,indole_3_acetic_acid,bmst000318,36712,1,,Indole-3-Acetic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,isethionic_acid,bmst000319,36722,1,,Isethionic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,isonicotinic_acid,bmst000320,36732,1,,isonicotinic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,itaconic_acid,bmst000321,36742,1,,itaconic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,kanamycin,bmst000322,36752,1,,Kanamycin,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,maleic_acid,bmst000323,36762,1,,Maleic Acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,malic_acid,bmst000324,36772,1,,malic_acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,melibiose,bmst000325,36782,1,,alpha-D (+) Melibiose,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl_4_aminobutyrate,bmst000326,36792,1,,Methyl 4-aminobutyrate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl_N_acetyl_alpha_D_glucosaminide,bmst000327,36802,1,,Methyl N-acetyl-alpha-D-glucosaminide,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,methyl_oxobutanoic_acid,bmst000328,36812,1,,3-methyl-2-oxobutinoic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,oxalate,bmst000329,36822,1,,oxalate,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phenylacetic_acid,bmst000330,36832,1,,phenylacetic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,phosphoenolpyruvic_acid,bmst000332,36842,1,,phosphoenolpyruvic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,polygalacturonic_acid,bmst000333,36852,1,,Polygalacturonic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,
entity,propionic_acid,bmst000334,36862,1,,Propionic acid,non-polymer,,,,,,,,,,no,no,no,no,no,,,,,no,not reported,,,,,,,,,,,,