-OEChem-01131113472D

 10  9  0     0  0  0  0  0  0999 V2000
 -329.6490  630.8870    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 -714.5450   78.6319    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  644.2620  647.5840    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
  322.9620  647.5840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.7665  446.7880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -714.5450  430.0470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  644.2620  296.1690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  644.2620  999.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  995.6780  647.5840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -999.0000  634.2090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  6  2  0  0  0  0
  3  4  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  1  0  0  0  0
  4  5  1  0  0  0  0
  6 10  1  0  0  0  0
M  CHG  1   3   1
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
1

> <PUBCHEM_SUBSTANCE_ID>
2096

> <PUBCHEM_SUBSTANCE_VERSION>
6

> <PUBCHEM_EXT_DATASOURCE_NAME>
BioCyc

> <PUBCHEM_EXT_DATASOURCE_REGID>
ACETYLCHOLINE

> <PUBCHEM_SUBSTANCE_COMMENT>
TYPES: Compounds
Is a product of enzyme EC 2.3.1.6
Is a reactant of enzyme EC 3.1.1.7

> <PUBCHEM_SUBSTANCE_SYNONYM>
51-84-3
Ach
O-Acetylcholine
acetylcholine

> <PUBCHEM_GENERIC_REGISTRY_NAME>
51-84-3

> <PUBCHEM_XREF_EXT_ID>
ACETYLCHOLINE

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.biocyc.org

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://biocyc.org/META/NEW-IMAGE?type=COMPOUND&object=ACETYLCHOLINE

> <PUBCHEM_CID_ASSOCIATIONS>
187  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$