LMST01010335
  LIPID_MAPS_STRUCTURE_DATABASE

 36 39  0  0  0  0  0  0  0  0999 V2000
    7.0101    7.4865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2346    7.0386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2346    6.1430    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.0101    5.6952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7858    6.1430    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.5613    5.6952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3371    6.1430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3371    7.0386    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.5613    7.4865    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.7858    7.0386    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.5613    8.3820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3371    8.8299    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.1125    8.3820    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.1125    7.4865    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.6639    7.4865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6639    8.3820    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.8882    8.8299    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.1125    9.0762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7858    7.6657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8882    9.5463    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.1588    9.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5086    9.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1291    9.5463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7496    9.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3701    9.5463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9906    9.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3701    8.9415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3371    7.8000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1125    6.7915    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3904    9.1198    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8882   10.3103    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5613    6.8063    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.7503    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3371    9.5101    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3441    8.7748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7858    5.2475    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
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  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
  8 28  1  1  0  0  0
 14 29  1  6  0  0  0
 17 30  1  6  0  0  0
 20 31  1  1  0  0  0
  9 32  1  6  0  0  0
  3 33  1  6  0  0  0
  5 36  1  6  0  0  0
 12 34  1  6  0  0  0
 16 35  1  6  0  0  0
M  END
> <LM_ID>
LMST01010335

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5alpha-cholestan-3alpha,12alpha,16alpha-triol

> <FORMULA>
C27H48O3

> <MASS>
420.36

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Cholesterol and derivatives [ST0101]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
UYOSSIFSBNNKRC-XJZYBRFWSA-N

> <INCHI>
InChI=1S/C27H48O3/c1-16(2)7-6-8-17(3)25-23(29)14-22-20-10-9-18-13-19(28)11-12-26(18,4)21(20)15-24(30)27(22,25)5/h16-25,28-30H,6-15H2,1-5H3/t17-,18+,19-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
187433

> <ABBREVIATION>
ST 27:0;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
25195167

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$