LMST01031044
  LIPID_MAPS_STRUCTURE_DATABASE

 35 38  0     0  0            999 V2000
    8.4475    8.1711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5339    7.6432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5339    6.5882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4475    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3614    6.5882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2750    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1891    6.5882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1891    7.6432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2750    8.1711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3614    7.6432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2750    9.2261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1891    9.7538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1026    9.2261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1026    8.1711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9303    8.1711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9303    9.2261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0164    9.7538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1026   10.0441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3614    8.3821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0164   10.5979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1571   10.8279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7474   11.0199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1891    8.5404    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1026    7.3522    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.6082   10.0953    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0164   11.4980    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2750    7.3698    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.1255    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2094   12.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2094   11.0199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0369   11.0199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1232   10.4924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4785   10.5979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4785    9.5428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3921    9.0153    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 33  1  0  0  0  0
 33 30  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
  8 23  1  1  0  0  0
 14 24  1  6  0  0  0
 17 25  1  6  0  0  0
 20 26  1  1  0  0  0
  9 27  1  6  0  0  0
  3 28  1  1  0  0  0
 30 29  1  0  0  0  0
 30 32  1  0  0  0  0
 32 31  2  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
M  END
> <LM_ID>
LMST01031044

> <COMMON_NAME>
Ficisterol

> <SYSTEMATIC_NAME>
23-ethyl-24-methyl-27-norcholesta-5,25-dien-3beta-ol

> <FORMULA>
C29H48O

> <MASS>
412.37

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DPYKOZVWDOMMAH-CYACLDDTSA-N

> <INCHI>
InChI=1S/C29H48O/c1-7-19(3)21(8-2)17-20(4)25-11-12-26-24-10-9-22-18-23(30)13-15-28(22,5)27(24)14-16-29(25,26)6/h7,9,19-21,23-27,30H,1,8,10-18H2,2-6H3/t19?,20-,21?,23+,24+,25-,26+,27+,28+,29-/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
173006

> <ABBREVIATION>
ST 29:2;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
52931358

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
68564

> <CITATION>
-

$$$$