-OEChem-01131113502D

 16 16  0     0  0  0  0  0  0999 V2000
    0.9137    0.3589    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6074   -0.9026    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9736    0.3921    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.3380    0.2849    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2560   -0.0166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1721   -0.0278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5457    0.3921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2560   -0.8416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1721   -0.8323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6000   -0.0906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5457   -1.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3897   -0.3256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5648    1.1098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6912    0.8064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0278   -0.1591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3842    1.1098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1 10  1  0  0  0  0
  2 10  2  0  0  0  0
  3  5  1  0  0  0  0
  3 12  1  0  0  0  0
  3 13  1  0  0  0  0
  3 14  1  0  0  0  0
  4 10  1  0  0  0  0
  4 15  1  0  0  0  0
  4 16  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  2  0  0  0  0
  6  7  2  0  0  0  0
  6  9  1  0  0  0  0
  8 11  1  0  0  0  0
  9 11  2  0  0  0  0
M  CHG  1   3   1
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
1

> <PUBCHEM_SUBSTANCE_ID>
93165415

> <PUBCHEM_SUBSTANCE_VERSION>
2

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChEBI

> <PUBCHEM_EXT_DATASOURCE_REGID>
CHEBI:7514

> <PUBCHEM_SUBSTANCE_SYNONYM>
(m-Hydroxyphenyl)trimethylammonium dimethylcarbamate
3-Trimethylammoniumphenyl N,N-dimethylcarbamate
3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium
59-99-4
CHEBI:7514
Eustigmin
Eustigmine
Neostigmine
Prostigmine
Vagostigmine
m-Trimethylammoniumphenyldimethylcarbamate

> <PUBCHEM_GENERIC_REGISTRY_NAME>
59-99-4

> <PUBCHEM_XREF_EXT_ID>
CHEBI:7514

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.ebi.ac.uk/chebi/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:7514

> <PUBCHEM_CID_ASSOCIATIONS>
4456  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$