-OEChem-06111213162D

 10 11  0     1  0  0  0  0  0999 V2000
   29.3717  -20.9236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.6695  -17.4081    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   26.7790  -17.8747    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   26.7739  -18.9947    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   29.3872  -19.5599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.5524  -17.8643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.4124  -18.9947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7991  -18.8443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7991  -19.5650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.6610  -16.1662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  5  1  1  6  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 10  1  0  0  0  0
  3  6  1  0  0  0  0
  3  8  1  0  0  0  0
  4  7  1  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  8  9  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
3994

> <PUBCHEM_SUBSTANCE_VERSION>
8

> <PUBCHEM_EXT_DATASOURCE_NAME>
KEGG

> <PUBCHEM_EXT_DATASOURCE_REGID>
C00729

> <PUBCHEM_SUBSTANCE_COMMENT>
Pathway: <a href="http://www.genome.jp/kegg-bin/show_pathway?map00960+C00729">map00960</a> Tropane, piperidine and pyridine alkaloid biosynthesis
Is a reactant of enzyme EC: 1.1.1.206
Is a reactant of enzyme EC: 2.3.1.185
Is a reactant of enzyme EC: 2.3.1.-
Is a reactant of enzyme EC: 3.1.1.10

> <PUBCHEM_SUBSTANCE_SYNONYM>
120-29-6
3alpha-Tropanol
C00729
Tropine

> <PUBCHEM_GENERIC_REGISTRY_NAME>
120-29-6

> <PUBCHEM_XREF_EXT_ID>
C00729

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.genome.jp/kegg/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.genome.jp/dbget-bin/www_bget?cpd:C00729

> <PUBCHEM_CID_ASSOCIATIONS>
8424  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

> <PUBCHEM_BONDANNOTATIONS>
5  1  6

$$$$