LMST04010391
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0  0  0  0  0  0  0  0999 V2000
    6.5276    7.0443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7496    6.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7496    5.6968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5276    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3055    5.6968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0835    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8616    5.6968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8616    6.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0835    7.0443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3055    6.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0835    7.9426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8616    8.3919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6395    7.9426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6395    7.0443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1956    7.0443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1956    7.9426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.4176    9.1106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6860    9.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0400    9.4699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6624    9.1106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2848    9.4699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4448    5.2752    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    5.3755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8616    9.0637    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2848   10.0950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9071    9.1106    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8616    7.3588    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0666    6.2888    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6395    6.3472    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9214    8.6827    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4176    9.8769    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  1  0  0  0  0
 11 12  1  0  0  0  0
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 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
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 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
  7 25  1  6  0  0  0
  3 26  2  0  0  0  0
 12 27  2  0  0  0  0
 24 28  2  0  0  0  0
 24 29  1  0  0  0  0
  8 30  1  1  0  0  0
  9 31  1  6  0  0  0
 14 32  1  6  0  0  0
 17 33  1  6  0  0  0
 20 34  1  1  0  0  0
M  END
> <LM_ID>
LMST04010391

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
7alpha-Hydroxy-3,12-dioxochola-1,4-dien-24-oic Acid

> <FORMULA>
C24H32O5

> <MASS>
400.22

> <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>
166723

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5284135

> <LIPIDBANK_ID>
BBA0675

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST04010391

$$$$