LMST01010285
  LIPID_MAPS_STRUCTURE_DATABASE

 36 39  0  0  0  0  0  0  0  0999 V2000
    6.8744    6.7773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1049    6.3329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1049    5.4444    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.8744    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6438    5.4444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4134    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1830    5.4444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1830    6.3329    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.4134    6.7773    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.6438    6.3329    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.4134    7.6659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1830    8.1101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9526    7.6659    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.9526    6.7773    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.4918    6.7773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4918    7.6659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7223    8.1101    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.9526    8.3545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6438    6.9551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7223    8.8211    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.9985    9.0148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3378    9.1764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9534    8.8211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1846    8.8211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8003    9.1764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1846    8.2208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2206    8.3979    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7223    9.5790    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.1266    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1830    7.0882    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3966    6.0299    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9526    6.0878    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.5691    9.1764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5750   10.0649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3444   10.5092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2330   10.5092    0.0000 C   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  2  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 33  2  0  0  0  0
 33 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  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 27  1  6  0  0  0
 20 28  1  1  0  0  0
  3 29  1  1  0  0  0
  8 30  1  1  0  0  0
  9 31  1  6  0  0  0
 14 32  1  6  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
M  END
> <LM_ID>
LMST01010285

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
24-vinyloxy-cholest-5,23Z-dien-3beta-ol

> <FORMULA>
C29H46O2

> <MASS>
426.35

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Cholesterol and derivatives [ST0101]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PNAJLVVZORLZKN-JDOUOGMTSA-N

> <INCHI>
InChI=1S/C29H46O2/c1-7-31-27(19(2)3)13-8-20(4)24-11-12-25-23-10-9-21-18-22(30)14-16-28(21,5)26(23)15-17-29(24,25)6/h7,9,13,19-20,22-26,30H,1,8,10-12,14-18H2,2-6H3/b27-13-/t20-,22+,23+,24-,25+,26+,28+,29-/m1/s1

> <SMILES>
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@]([H])(C)C/C=C(\OC=C)/C(C)C)CC[C@@]4([H])[C@]3([H])CC=C2C[C@@H](O)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
137806

> <ABBREVIATION>
ST 29:3;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
52931317

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
127542

> <CITATION>
-

$$$$