LMST01050019
  LIPID_MAPS_STRUCTURE_DATABASE

 36 39  0  0  0  0  0  0  0  0999 V2000
    6.9000    6.8117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1156    6.3587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1156    5.4529    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.9000    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6842    5.4529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4687    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2532    5.4529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2532    6.3587    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.4687    6.8117    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.6842    6.3587    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.4687    7.7173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2532    8.1703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0374    7.7173    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.0374    6.8117    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.6063    6.8117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6063    7.7173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8219    8.1703    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.0374    8.4193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6842    6.9928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8219    8.8948    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.0843    9.0923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4494    9.2571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0770    8.8948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7045    9.2571    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.3299    8.4635    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8219    9.6673    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.1290    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2532    7.1286    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4515    6.0497    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0374    6.1088    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.3128    8.9058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9213    9.2571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7045    9.9595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3128    8.2579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1047   10.3057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3181   10.3139    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 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
 17 25  1  6  0  0  0
 20 26  1  1  0  0  0
  3 27  1  1  0  0  0
  8 28  1  1  0  0  0
  9 29  1  6  0  0  0
 14 30  1  6  0  0  0
 24 31  1  0  0  0  0
 31 32  1  0  0  0  0
 33 24  1  0  0  0  0
 31 34  1  0  0  0  0
 33 35  1  0  0  0  0
 33 36  2  0  0  0  0
M  END
> <LM_ID>
LMST01050019

> <COMMON_NAME>
24-Isopropenylcholesterol

> <SYSTEMATIC_NAME>
24-isopropenyl-cholest-5-en-3beta-ol

> <FORMULA>
C30H50O

> <MASS>
426.39

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
C24-propyl sterols and derivatives [ST0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DGSFHNTYGAUZML-QZHPSQRPSA-N

> <INCHI>
InChI=1S/C30H50O/c1-19(2)24(20(3)4)10-8-21(5)26-12-13-27-25-11-9-22-18-23(31)14-16-29(22,6)28(25)15-17-30(26,27)7/h9,20-21,23-28,31H,1,8,10-18H2,2-7H3/t21-,23+,24?,25+,26-,27+,28+,29+,30-/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 30:2;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14213727

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$