LMST04030188
  LIPID_MAPS_STRUCTURE_DATABASE

 38 41  0  0  0  0  0  0  0  0999 V2000
    9.1393    6.8479    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.1346    8.5198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4269    8.0689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4183    7.2622    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.8662    8.1061    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.8632    7.2699    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.3107    7.2648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3137    8.1011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5914    8.5244    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.1369    7.6680    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8396    8.9965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5942    9.3406    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.3026    9.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5925   10.1575    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0081    9.3356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7162    9.7411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4218    9.3307    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   14.1301    9.7363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8624    6.4573    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.4190    8.5145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6988    6.8479    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.6988    6.0163    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.4183    5.6019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1393    6.0163    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.2692    6.8479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2692    6.0225    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.9840    5.6098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6988    7.6733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.6098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3045    8.8401    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9453    9.7382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6543    9.4469    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1301   10.3966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6988    5.2475    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6504    5.5051    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4183    6.4609    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9840    7.2606    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.0100    8.0578    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  6  1  0  0  0  0
  5  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  6  7  1  0  0  0  0
  1 10  1  1  0  0  0
  5 11  1  1  0  0  0
  9 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  1  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
  6 19  1  6  0  0  0
 17 20  1  6  0  0  0
  4 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24  1  1  0  0  0  0
 21 37  1  0  0  0  0
 37 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 22  1  0  0  0  0
 21 28  1  1  0  0  0
  9 30  1  6  0  0  0
 12 31  1  6  0  0  0
 18 32  1  0  0  0  0
 18 33  2  0  0  0  0
 22 34  1  1  0  0  0
 26 29  1  6  0  0  0
 24 35  1  6  0  0  0
  4 36  1  6  0  0  0
 37 38  1  1  0  0  0
M  END
> <LM_ID>
LMST04030188

> <COMMON_NAME>
(25R)-1beta,3alpha,7alpha-trihydroxy-5beta-cholestan-26-oic acid

> <SYSTEMATIC_NAME>
(25R)-1beta,3alpha,7alpha-trihydroxy-5beta-cholestan-26-oic acid

> <FORMULA>
C27H46O5

> <MASS>
450.33

> <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>
187810

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
52931527

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
Bile salts of vertebrates:
structural variation and possible evolutionary significance
Alan F. Hofmann, Lee R. Hagey, and Matthew D. Krasowski
J. Lipid Res. 2010 51:(2) 226-246

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST04030188

$$$$