LMST01060010
  LIPID_MAPS_STRUCTURE_DATABASE

 34 38  0     0  0            999 V2000
    8.3450    8.5316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4050    7.9889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4050    6.9036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3450    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2849    6.9036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2249    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1649    6.9036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1649    7.9889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2249    8.5316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2849    7.9889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2249    9.6170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1649   10.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1048    9.6170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1048    8.5316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9848    8.5316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9848    9.6170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0449   10.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1048   10.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2849    8.7489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0449   11.0282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1609   11.2648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5488   11.0282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3010   11.4621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6537   10.5112    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0449   11.9539    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327    6.5154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1649    8.9116    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2043    7.6188    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1048    7.6895    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.0298   11.0412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7589   11.4621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0538   10.1666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7968   11.4621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5618   11.9298    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 33  1  0  0  0  0
 33 22  1  0  0  0  0
 22 23  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 24  1  6  0  0  0
 20 25  1  1  0  0  0
  3 26  1  1  0  0  0
  8 27  1  1  0  0  0
  9 28  1  6  0  0  0
 14 29  1  6  0  0  0
 23 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
 33 34  1  6  0  0  0
 22 34  1  6  0  0  0
M  END
> <LM_ID>
LMST01060010

> <COMMON_NAME>
(22R,23R)-methylenecholesterol

> <SYSTEMATIC_NAME>
(22R,23R)-methylene-cholest-5-en-3beta-ol

> <FORMULA>
C28H46O

> <MASS>
398.35

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Gorgosterols and derivatives [ST0106]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MEMPEKZNYBWOLL-QEEIINJBSA-N

> <INCHI>
InChI=1S/C28H46O/c1-17(2)14-19-15-23(19)18(3)24-8-9-25-22-7-6-20-16-21(29)10-12-27(20,4)26(22)11-13-28(24,25)5/h6,17-19,21-26,29H,7-16H2,1-5H3/t18-,19-,21+,22+,23+,24-,25+,26+,27+,28-/m1/s1

> <SMILES>
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@]([H])(C)[C@@H]5C[C@H]5CC(C)C)CC[C@@]4([H])[C@]3([H])CC=C2C[C@@H](O)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
173043

> <ABBREVIATION>
ST 28:2;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14680451

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
178550

> <CITATION>
-

$$$$