LMST04030104
  LIPID_MAPS_STRUCTURE_DATABASE

 37 40  0  0  0  0  0  0  0  0999 V2000
    6.5438    7.2155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7563    6.7608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7563    5.8516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5438    5.3968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3312    5.8516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1187    5.3968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9063    5.8516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9063    6.7608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1187    7.2155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3312    6.7608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1187    8.1248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9063    8.5795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6936    8.1248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6936    7.2155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2686    7.2155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2686    8.1248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4812    8.5795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6936    8.8296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3312    7.3975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4812    9.3069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7407    9.5053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1111    9.6706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7411    9.3069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3710    9.6706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0009    9.3069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6310    9.6706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0009    8.6928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9911    8.8739    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4812   10.0825    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4965    5.4248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9063    9.2595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6324    8.8309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3312    5.2475    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    5.5264    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9063    7.5338    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1015    6.4508    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6936    6.5100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  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  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 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
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 20  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
  1 10  1  0  0  0  0
  5 10  1  0  0  0  0
  9 10  1  0  0  0  0
  8 14  1  0  0  0  0
 13 17  1  0  0  0  0
 13 18  1  1  0  0  0
 10 19  1  1  0  0  0
 20 21  1  6  0  0  0
 17 28  1  6  0  0  0
 20 29  1  1  0  0  0
  7 30  1  6  0  0  0
 12 31  1  6  0  0  0
 25 32  1  0  0  0  0
  5 33  1  1  0  0  0
  3 34  2  0  0  0  0
  8 35  1  1  0  0  0
  9 36  1  6  0  0  0
 14 37  1  6  0  0  0
M  END
> <LM_ID>
LMST04030104

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
7alpha,12alpha,25-Trihydroxy-5beta-cholestan-3-one

> <FORMULA>
C27H46O4

> <MASS>
434.34

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Bile acids and derivatives [ST04]

> <SUB_CLASS>
C27 bile acids, alcohols, and derivatives [ST0403]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
187967

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5284264

> <LIPIDBANK_ID>
BBA0430

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST04030104

$$$$