LMST01031043
  LIPID_MAPS_STRUCTURE_DATABASE

 36 39  0     0  0            999 V2000
    8.3327    8.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3999    7.6763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3999    6.5993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3327    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2653    6.5993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1982    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1310    6.5993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1310    7.6763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1982    8.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2653    7.6763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1982    9.2919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1310    9.8304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0637    9.2919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0637    8.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9294    8.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9294    9.2919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9966    9.8304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0637   10.1267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2653    8.4304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9966   10.6923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1193   10.9270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7428   11.1229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4890   10.6923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9812   10.6923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9812    9.9645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6006   10.1793    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9966   11.6109    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.2138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1310    8.5916    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1777    7.3089    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0637    7.3792    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.6966   12.0557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2351   11.1229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7736   12.0557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7277   11.1229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6604   10.5844    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  1  0  0  0  0
 33 24  1  0  0  0  0
 24 35  1  0  0  0  0
 24 25  2  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 26  1  6  0  0  0
 20 27  1  1  0  0  0
  3 28  1  1  0  0  0
  8 29  1  1  0  0  0
  9 30  1  6  0  0  0
 14 31  1  6  0  0  0
 33 32  1  0  0  0  0
 33 34  1  0  0  0  0
 35 36  1  0  0  0  0
M  END
> <LM_ID>
LMST01031043

> <COMMON_NAME>
Durissimasterol

> <SYSTEMATIC_NAME>
24,24,26-trimethylcholest-5,25(27)-dien-3beta-ol

> <FORMULA>
C30H50O

> <MASS>
426.39

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XTQQODGMWJGROK-CMZGQUJUSA-N

> <INCHI>
InChI=1S/C30H50O/c1-8-21(3)28(4,5)16-13-20(2)25-11-12-26-24-10-9-22-19-23(31)14-17-29(22,6)27(24)15-18-30(25,26)7/h9,20,23-27,31H,3,8,10-19H2,1-2,4-7H3/t20-,23+,24+,25-,26+,27+,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)CC)CC[C@@]4([H])[C@]3([H])CC=C2C[C@@H](O)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
173005

> <ABBREVIATION>
ST 30:2;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
52931357

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
2737399

> <CITATION>
-

$$$$