LMST01080014
  LIPID_MAPS_STRUCTURE_DATABASE

 35 40  0  0  0  0  0  0  0  0999 V2000
    6.9353    7.2206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2449    6.8219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9353    5.6259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3163    5.6259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0068    6.0246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0068    6.8219    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.3163    7.2206    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.6257    6.8219    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.3163    8.0179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6973    8.0179    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.6973    7.2206    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.0784    7.2206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0784    8.0179    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.3879    8.4166    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.6973    8.6359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6257    7.3803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0068    7.4998    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3012    6.5501    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6973    6.6021    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7690    8.4166    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3879    9.2141    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.9269    9.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2388   10.0326    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7614    9.2058    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.6792    9.4682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6026    9.2262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1621    9.7905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2449    6.0246    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.5544    5.6260    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6257    6.0246    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.6257    5.2273    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0068    8.4166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0068    9.2140    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0800   10.0528    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   14.8502    9.8464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2 28  1  0  0  0  0
 28  3  1  0  0  0  0
  3 30  1  0  0  0  0
 30  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  9  1  0  0  0  0
  9 32  1  0  0  0  0
 32 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
  1  8  1  0  0  0  0
 30  8  1  0  0  0  0
  7  8  1  0  0  0  0
  6 11  1  0  0  0  0
 10 14  1  0  0  0  0
 10 15  1  1  0  0  0
  8 16  1  1  0  0  0
  6 17  1  1  0  0  0
  7 18  1  6  0  0  0
 11 19  1  6  0  0  0
 13 20  1  1  0  0  0
 14 21  1  1  0  0  0
 21 22  1  6  0  0  0
 24 23  1  6  0  0  0
 24 25  1  1  0  0  0
 25 26  1  0  0  0  0
 34 27  1  0  0  0  0
 27 23  1  0  0  0  0
 21 24  1  0  0  0  0
 24 20  1  0  0  0  0
 28 29  1  1  0  0  0
 30 31  1  6  0  0  0
 32 33  2  0  0  0  0
 34 26  1  1  0  0  0
 34 35  1  0  0  0  0
M  END
> <LM_ID>
LMST01080014

> <COMMON_NAME>
Hecogenin

> <SYSTEMATIC_NAME>
(25R)-12-oxo-spirostan-3beta-ol

> <FORMULA>
C27H42O4

> <MASS>
430.31

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Spirostanols and derivatives [ST0108]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(25R)-3beta-hydroxy-5alpha-spirostan-12-one

> <KEGG_ID>
C08902

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
5633

> <CAYMAN_ID>
21372

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
91453

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST01080014

$$$$