LMST04010314
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    6.8855    7.1868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1095    6.7387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1095    5.8428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8855    5.3947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6614    5.8428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4374    5.3947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2135    5.8428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2135    6.7387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4374    7.1868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6614    6.7387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4374    8.0828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2135    8.5309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9894    8.0828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9894    7.1868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5414    7.1868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5414    8.0828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7654    8.5309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9894    8.7774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6614    7.3662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7654    9.2477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0357    9.4432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3862    9.6061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0070    9.2477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6278    9.6061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6614    5.2475    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.5224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2135    9.2010    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2485    9.2477    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2135    7.5005    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4205    6.4332    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9894    6.4916    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.2680    8.8210    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7654   10.0121    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
  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
  5 25  1  1  0  0  0
  3 26  1  6  0  0  0
 12 27  1  6  0  0  0
 24 28  1  0  0  0  0
  8 29  1  1  0  0  0
  9 30  1  6  0  0  0
 14 31  1  6  0  0  0
 17 32  1  6  0  0  0
 20 33  1  1  0  0  0
M  END
> <LM_ID>
LMST04010314

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5beta-Cholane-3alpha,12alpha,24-triol

> <FORMULA>
C24H42O3

> <MASS>
378.31

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Bile acids and derivatives [ST04]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RPHJWYNFTCSHCD-GOZZBPKESA-N

> <INCHI>
InChI=1S/C24H42O3/c1-15(5-4-12-25)19-8-9-20-18-7-6-16-13-17(26)10-11-23(16,2)21(18)14-22(27)24(19,20)3/h15-22,25-27H,4-14H2,1-3H3/t15-,16-,17-,18+,19-,20+,21+,22+,23+,24-/m1/s1

> <SMILES>
C1[C@]2(C)[C@@]3([H])C[C@H](O)[C@]4(C)[C@@]([H])([C@]([H])(C)CCCO)CC[C@@]4([H])[C@]3([H])CC[C@]2([H])C[C@H](O)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 24:0;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5284062

> <LIPIDBANK_ID>
BBA0490

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$