LMST01031383
  LIPID_MAPS_STRUCTURE_DATABASE

 40 43  0  0  0  0  0  0  0  0999 V2000
   10.7623   -8.1665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7568   -6.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8980   -6.6835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9068   -7.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6248   -6.6737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6213   -7.6659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3389   -7.6720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3424   -6.6796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4853   -6.1774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7595   -7.1936    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5934   -5.6171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4746   -5.2127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3292   -4.7276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4866   -4.2396    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.1661   -5.2148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0066   -4.7336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8436   -5.2206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6840   -4.7394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6202   -8.6302    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.8436   -6.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0532   -8.1665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0532   -9.1532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9068   -9.6448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2051   -7.6768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3569   -8.1665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3569   -9.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2051   -9.6354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0532   -7.1873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3316   -5.8028    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7186   -4.7372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9068   -8.6542    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0101   -3.7336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4873   -9.6339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3346   -3.7276    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1403  -10.1494    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9063  -10.6448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1626   -6.2148    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7623   -9.1532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4909   -7.6665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.7096   -5.7206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  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
  1 10  1  1  0  0  0
  5 11  1  1  0  0  0
  9 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  1  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
  6 19  1  6  0  0  0
 17 20  1  0  0  0  0
  4 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 21 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 22  1  0  0  0  0
 21 28  1  1  0  0  0
  9 29  1  6  0  0  0
 12 30  1  6  0  0  0
  4 31  1  6  0  0  0
 16 32  2  0     0  0
 26 33  1  6     0  0
 13 34  1  1     0  0
 22 35  1  6     0  0
 23 36  2  0     0  0
 15 37  1  1     0  0
 38  1  1  0  0  0  0
 23 38  1  0  0  0  0
 25 39  1  6     0  0
 17 40  1  0     0  0
M  END
> <LM_ID>
LMST01031383

> <COMMON_NAME>
25-Methyldolichosterone

> <SYSTEMATIC_NAME>
2alpha,3alpha,22R,23R-Tetrahydroxy-25-methyl-5alpha-ergost-24(28)-en-6-one

> <FORMULA>
C29H48O5

> <MASS>
476.35

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Ergosterols and C24-methyl derivatives [ST0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HAOQPQZVDMAOKT-SBQKBANHSA-N

> <INCHI>
InChI=1S/C29H48O5/c1-15(25(33)26(34)16(2)27(3,4)5)18-8-9-19-17-12-22(30)21-13-23(31)24(32)14-29(21,7)20(17)10-11-28(18,19)6/h15,17-21,23-26,31-34H,2,8-14H2,1,3-7H3/t15-,17-,18+,19-,20-,21+,23-,24+,25+,26+,28+,29+/m0/s1

> <SMILES>
[C@]12(CC(=O)[C@@]3([H])C[C@H](O)[C@H](O)C[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@]([H])([C@@](C)([H])[C@@H](O)[C@H](O)C(=C)C(C)(C)C)CC[C@@]21[H])[H]

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 29:2;O5

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
13991216

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
3885

> <CITATION>
-

$$$$