LMST01060033
  LIPID_MAPS_STRUCTURE_DATABASE

 38 42  0     0  0            999 V2000
    8.8324   -9.0869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7141   -9.5960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7141  -10.6141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8324  -11.1232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9507  -10.6141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9507   -9.5960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5960   -9.0869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4777   -9.5959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4777  -10.6141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5960  -11.1232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5959   -8.0687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4776   -7.5597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3594   -8.0687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3594   -9.0868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2411   -7.5596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1229   -8.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1230   -9.0867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2411   -6.5413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1228   -6.0323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3593   -6.0324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0045   -6.5412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8863   -6.0322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7680   -6.5411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8863   -5.0139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7680   -7.5594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6497   -6.0321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7665   -7.3050    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5960   -9.7232    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7141  -11.6324    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4647   -8.8362    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5960  -12.1414    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0690  -11.1232    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8030   -8.5817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4480   -7.0544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3846   -9.7430    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0045   -7.5416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0043   -5.5232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8324   -8.0869    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  1  1  0     0  0
  2  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  3  1  0     0  0
  7 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14  8  1  0     0  0
 13 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 14 17  1  0     0  0
 15 18  1  0     0  0
 18 19  1  0     0  0
 18 20  1  6     0  0
 19 21  1  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 22 24  1  6     0  0
 23 25  1  0     0  0
 23 26  1  0     0  0
 15 27  1  6     0  0
  7 28  1  6     0  0
  3 29  1  6     0  0
  8 30  1  1     0  0
 10 31  1  1     0  0
  5 32  1  1     0  0
  2 33  1  1     0  0
 13 34  1  1     0  0
 14 35  1  6     0  0
 21 36  1  0     0  0
 21 37  1  1     0  0
 19 37  1  1     0  0
  1 38  1  1     0  0
M  END
> <LM_ID>
LMST01060033

> <COMMON_NAME>
Ehrensteroid F

> <SYSTEMATIC_NAME>
Gorgostan-1beta,3beta,5alpha,6beta-tetraol

> <FORMULA>
C30H52O4

> <MASS>
476.39

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Gorgosterols and derivatives [ST0106]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DUTCLUPBHBFYLZ-SXADYKHJSA-N

> <INCHI>
InChI=1S/C30H52O4/c1-16(2)18(4)28(6)15-24(28)17(3)21-8-9-22-20-13-26(33)30(34)14-19(31)12-25(32)29(30,7)23(20)10-11-27(21,22)5/h16-26,31-34H,8-15H2,1-7H3/t17-,18+,19-,20-,21+,22-,23-,24+,25+,26+,27+,28+,29-,30-/m0/s1

> <SMILES>
[C@@H]1(O)C[C@H](O)C[C@]2(O)[C@H](O)C[C@@]3([H])[C@]4([H])CC[C@]([H])([C@H](C)[C@H]5C[C@]5(C)[C@H](C)C(C)C)[C@@]4(C)CC[C@]3([H])[C@@]12C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 30:1;O4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171120129

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
358800

> <CITATION>
34662651

$$$$