LMST04010325
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0  0  0  0  0  0  0  0999 V2000
    6.5195    7.0335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7462    6.5870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7462    5.6941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5195    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2928    5.6941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0662    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8396    5.6941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8396    6.5870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0662    7.0335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2928    6.5870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0662    7.9264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8396    8.3730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6128    7.9264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6128    7.0335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1595    7.0335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1595    7.9264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3862    8.3730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6128    8.6186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2928    7.2122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3862    9.0873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6590    9.2822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0049    9.4445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6235    9.0873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2422    9.4445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    5.3748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8396    9.0408    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2422   10.0659    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8607    9.0873    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8396    7.3461    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6128    6.3406    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8870    8.6621    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3862    9.8491    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  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  2  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
  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
  3 25  2  0  0  0  0
 12 26  2  0  0  0  0
 24 27  2  0  0  0  0
 24 28  1  0  0  0  0
  8 29  1  1  0  0  0
 14 30  1  6  0  0  0
 17 31  1  6  0  0  0
 20 32  1  1  0  0  0
M  END
> <LM_ID>
LMST04010325

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
3,12-Dioxochola-1,4,9(11)-trien-24-oic Acid

> <FORMULA>
C24H30O4

> <MASS>
382.21

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Bile acids and derivatives [ST04]

> <SUB_CLASS>
C24 bile acids, alcohols, and derivatives [ST0401]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
185672

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5284072

> <LIPIDBANK_ID>
BBA0609

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST04010325

$$$$