LMST01010236
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    8.7015    7.2670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6970    8.9033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9887    8.4902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9959    7.6725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4130    8.4983    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.4101    7.6799    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.8268    7.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8297    8.4935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1228    8.9077    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.3871    9.3699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1140    9.7034    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.8189   10.1035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1239   10.5061    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5092    9.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2025   10.0987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8929    9.6969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5860   10.0938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4092    6.8845    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8929    8.8890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2918    7.2670    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2918    6.4531    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.9959    6.0476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7015    6.4531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5922    7.6709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8926    7.2670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8926    6.4592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5922    6.0554    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.2918    8.0747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    6.0554    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8208    9.2167    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4904   10.0956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2918    5.6453    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5922    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  2  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
  5 10  1  1  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  1  0  0  0
 12 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
  6 18  1  6  0  0  0
 16 19  1  0  0  0  0
  4 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23  1  1  0  0  0  0
 20 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 21  1  0  0  0  0
 20 28  1  1  0  0  0
 26 29  2  0  0  0  0
  9 30  1  6  0  0  0
 11 31  1  6  0  0  0
 21 32  1  6  0  0  0
 27 33  1  6  0  0  0
M  END
> <LM_ID>
LMST01010236

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
4alpha-methyl-5alpha-cholesta-8-en-3-one

> <FORMULA>
C28H46O

> <MASS>
398.35

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Cholesterol and derivatives [ST0101]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SDZUXFFGOQZLPK-SINUOACOSA-N

> <INCHI>
InChI=1S/C28H46O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h18-20,22-24H,7-17H2,1-6H3/t19-,20+,22-,23+,24+,27-,28+/m1/s1

> <SMILES>
C12CC[C@@]3([H])[C@H](C)C(=O)CC[C@]3(C)C=1CC[C@]1(C)[C@@]([H])([C@@](C)([H])CCCC(C)C)CC[C@@]21[H]

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0062393

> <CHEBI_ID>
87050

> <ABBREVIATION>
ST 28:2;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000485690

> <PUBCHEM_COMPOUND_ID>
44263323

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$