LMST04050017
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0     0  0            999 V2000
    5.5000   -4.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3660   -5.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3660   -6.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5000   -6.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6340   -6.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6340   -5.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2321   -4.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0981   -5.1749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0981   -6.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2321   -6.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2320   -3.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0980   -3.1749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9641   -3.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9641   -4.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8301   -3.1748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6962   -3.6748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6963   -4.6748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7680   -6.6750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9641   -6.6750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3660   -4.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0981   -4.3749    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9641   -2.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0980   -2.1749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1230   -5.5158    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8301   -2.1748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6961   -1.6747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9640   -1.6748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4399   -2.8511    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5621   -2.1747    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6960   -0.6747    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2557   -5.5098    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  1  2  0     0  0
  2  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  3  1  0     0  0
  7 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14  8  1  0     0  0
 13 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 14 17  1  0     0  0
  5 18  2  0     0  0
  9 19  1  6     0  0
  2 20  1  1     0  0
  8 21  1  1     0  0
 13 22  1  1     0  0
 12 23  1  6     0  0
 14 24  1  6     0  0
 15 25  1  0     0  0
 25 26  1  0     0  0
 25 27  1  6     0  0
 15 28  1  6     0  0
 26 29  1  0     0  0
 26 30  2  0     0  0
  7 31  1  6     0  0
M  END
> <LM_ID>
LMST04050017

> <COMMON_NAME>
Bendigole D

> <SYSTEMATIC_NAME>
24-dinor-3-oxo,7alpha,12alpha-dihydroxy-chola-1,4-dien-22-oic acid

> <FORMULA>
C22H30O5

> <MASS>
374.21

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Bile acids and derivatives [ST04]

> <SUB_CLASS>
C22 bile acids, alcohols, and derivatives [ST0405]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
54764154

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST04050017

$$$$