-OEChem-05171211432D

 36 39  0     1  0  0  0  0  0999 V2000
   13.8538  -21.7608    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   15.2532  -21.7608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5020  -21.7485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8538  -23.1602    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8538  -20.3613    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.3902  -19.0319    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   21.2007  -19.7316    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   22.3902  -17.6325    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   20.0112  -19.0319    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   23.6026  -16.9325    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   18.8217  -19.7316    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   24.8151  -19.0319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2007  -16.9328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0112  -17.6325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2007  -21.0611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8217  -21.0611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.8151  -17.6325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.6026  -15.5325    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   20.0112  -21.7608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3902  -16.2325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6322  -19.0319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8217  -18.3322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6322  -21.7608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4427  -19.7316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4427  -21.0611    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   24.8024  -14.8400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3902  -14.8325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.0149  -15.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.2273  -14.8400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.4397  -15.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.6522  -14.8400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.4397  -16.9400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3902  -20.4319    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.2007  -18.2622    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.0812  -20.3613    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.5926  -15.9425    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
 25  2  1  1  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 12  1  0  0  0  0
  6 33  1  6  0  0  0
  7  9  1  0  0  0  0
  7 15  1  0  0  0  0
  7 34  1  1  0  0  0
  8 10  1  0  0  0  0
  8 13  1  0  0  0  0
  8 20  1  1  0  0  0
  9 11  1  0  0  0  0
  9 14  1  0  0  0  0
  9 35  1  6  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 10 36  1  6  0  0  0
 11 16  1  0  0  0  0
 11 21  1  0  0  0  0
 11 22  1  1  0  0  0
 12 17  1  0  0  0  0
 13 14  1  0  0  0  0
 15 19  1  0  0  0  0
 16 19  2  0  0  0  0
 16 23  1  0  0  0  0
 18 26  1  0  0  0  0
 18 27  1  6  0  0  0
 21 24  1  0  0  0  0
 23 25  1  0  0  0  0
 24 25  1  0  0  0  0
 26 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
96024263

> <PUBCHEM_SUBSTANCE_VERSION>
3

> <PUBCHEM_EXT_DATASOURCE_NAME>
KEGG

> <PUBCHEM_EXT_DATASOURCE_REGID>
C18043

> <PUBCHEM_SUBSTANCE_COMMENT>
Pathway: <a href="http://www.genome.jp/kegg-bin/show_pathway?map00140+C18043">map00140</a> Steroid hormone biosynthesis
Is a reactant of enzyme EC: 2.8.2.2
Is a reactant of enzyme EC: 2.8.2.14
Is a reactant of enzyme EC: 3.1.6.2

> <PUBCHEM_SUBSTANCE_SYNONYM>
1256-86-6
C18043
Cholest-5-en-3beta-ol sulfate
Cholesterol sulfate

> <PUBCHEM_GENERIC_REGISTRY_NAME>
1256-86-6

> <PUBCHEM_XREF_EXT_ID>
C18043

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

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.genome.jp/dbget-bin/www_bget?cpd:C18043

> <PUBCHEM_CID_ASSOCIATIONS>
65076  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

> <PUBCHEM_BONDANNOTATIONS>
10  36  6
11  22  5
18  27  6
25  2  5
6  33  6
7  34  5
8  20  5
9  35  6

$$$$