LMST01060047
  LIPID_MAPS_STRUCTURE_DATABASE

 34 39  0     0  0            999 V2000
    8.4021    8.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4378    7.9100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4378    6.7964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4021    6.2397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3662    6.7964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3305    6.2397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2950    6.7964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2950    7.9100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3305    8.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3662    7.9100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3305    9.5801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2950   10.1369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2591    9.5801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2591    8.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1879    8.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1879    9.5801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2236   10.1369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2591   10.4431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3662    8.6896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2236   11.0278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3167   11.2706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9951   11.4730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7665   11.0278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5378   11.4730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3093   11.0278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0808   11.4730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3093   10.2756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8480   10.4976    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7478    6.3982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5362   12.1128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2591    7.6027    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.6915   11.8988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3662    5.6830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1610    6.2964    0.0000 O   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  2  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
 17 28  1  6  0  0  0
  3 29  1  1  0  0  0
 24 30  1  6  0  0  0
 14 31  1  6  0  0  0
 22 32  1  1  0  0  0
 23 32  1  1  0  0  0
  5 33  1  6     0  0
  6 33  1  6     0  0
  7 34  1  6     0  0
M  END
> <LM_ID>
LMST01060047

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5alpha,6alpha-epoxy-23-demethylgorgost-8-ene-3beta,7alpha-diol

> <FORMULA>
C29H46O3

> <MASS>
442.34

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Gorgosterols and derivatives [ST0106]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RYFQZHYAHJJUID-HVNPHGSJSA-N

> <INCHI>
InChI=1S/C29H46O3/c1-15(2)16(3)19-13-20(19)17(4)21-7-8-22-24-23(10-11-27(21,22)5)28(6)12-9-18(30)14-29(28)26(32-29)25(24)31/h15-22,25-26,30-31H,7-14H2,1-6H3/t16-,17-,18+,19-,20-,21-,22+,25+,26+,27-,28-,29+/m1/s1

> <SMILES>
C1[C@]2(C)C3CC[C@]4(C)[C@@]([H])([C@H](C)[C@H]5C[C@@H]5[C@H](C)C(C)C)CC[C@@]4([H])C=3[C@H](O)[C@@H]3O[C@@]32C[C@@H](O)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 29:3;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
132529868

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
308461

> <CITATION>
35031429

$$$$