LMST05020014
  LIPID_MAPS_STRUCTURE_DATABASE

 30 33  0     0  0            999 V2000
    9.0267   10.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1606    9.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1606    8.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0267    8.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8927    8.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7588    8.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6247    8.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7588   11.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6247   11.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4908    9.3606    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7588   10.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7588    9.3606    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.4908   12.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8927    9.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8927   10.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6247    9.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6247   10.8606    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.4418   11.6696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4908   11.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4418   10.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0296   10.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4908   10.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7509   12.6206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7290   12.8286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0817   13.3638    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2947    8.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945    7.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2947    7.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2947    7.3606    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.2947    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 19  9  1  0  0  0  0
 22 16  1  0  0  0  0
 11  8  1  0  0  0  0
 11 14  1  0  0  0  0
 16 11  1  0  0  0  0
 16  7  1  0  0  0  0
 14  5  1  0  0  0  0
 14  1  1  0  0  0  0
  8  9  1  0  0  0  0
  6  7  1  0  0  0  0
  4  5  1  0  0  0  0
  6  5  2  0  0  0  0
  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  3  2  1  0  0  0  0
  3 26  1  1  0  0  0
 22 10  1  6  0  0  0
 11 12  1  6  0  0  0
 19 13  1  1  0  0  0
 14 15  1  1  0  0  0
 16 17  1  1  0  0  0
 18 23  1  1  0  0  0
 19 18  1  0  0  0  0
 21 20  1  0  0  0  0
 18 21  1  0  0  0  0
 22 19  1  0  0  0  0
 22 20  1  0  0  0  0
 24 23  1  0  0  0  0
 25 23  2  0  0  0  0
 26 29  1  0  0  0  0
 29 27  2  0  0  0  0
 29 28  2  0  0  0  0
 29 30  1  0  0  0  0
M  END
> <LM_ID>
LMST05020014

> <COMMON_NAME>
Pregnenolone sulfate

> <SYSTEMATIC_NAME>
20-oxopregn-5-en-3beta-yl sulfate

> <FORMULA>
C21H32O5S

> <MASS>
396.20

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroid conjugates [ST05]

> <SUB_CLASS>
Sulfates [ST0502]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(3beta)-3-(sulfooxy)pregn-5-en-20-one; 5-pregnen-3beta-ol-20-one sulfate; pregnenolone sulfate

> <KEGG_ID>
C18044

> <HMDB_ID>
HMDB0060382

> <YMDB_ID>
-

> <CHEBI_ID>
35420

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
105074

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMST05020014

$$$$