LMST01031222
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0     0  0            999 V2000
    8.8362   -4.6197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7090   -5.1237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7090   -6.1313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8362   -6.6352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9636   -6.1313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9636   -5.1237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5818   -4.6197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4545   -5.1236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4545   -6.1313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5818   -6.6352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5817   -3.6119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4544   -3.1082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3271   -3.6119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3271   -4.6197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1997   -3.1081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0724   -3.6118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0725   -4.6195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1997   -2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0723   -1.5965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3270   -1.5966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9451   -2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8178   -1.5964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6906   -2.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6906   -3.1079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5632   -1.5963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5818   -5.2494    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4417   -4.3716    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0909   -6.6352    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7969   -4.1196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4147   -2.6081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3521   -5.2690    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.8178   -0.6069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9451   -3.0895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3734   -1.1153    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  2  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  2  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  1     0  0
 19 21  1  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 23 24  1  0     0  0
 23 25  1  0     0  0
  7 26  1  6     0  0
  8 27  1  1     0  0
  5 28  1  1     0  0
  2 29  1  1     0  0
 13 30  1  1     0  0
 14 31  1  6     0  0
 22 32  1  6     0  0
 21 33  1  6     0  0
 18 34  1  6     0  0
M  END
> <LM_ID>
LMST01031222

> <COMMON_NAME>
Sarcophytosterol

> <SYSTEMATIC_NAME>
23R-Methyl-ergosta-5,16-diene-3beta,20R-diol

> <FORMULA>
C29H48O2

> <MASS>
428.37

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
IRLJYXHINXXWKC-GHZBUWTKSA-N

> <INCHI>
InChI=1S/C29H48O2/c1-18(2)20(4)19(3)17-29(7,31)26-11-10-24-23-9-8-21-16-22(30)12-14-27(21,5)25(23)13-15-28(24,26)6/h8,11,18-20,22-25,30-31H,9-10,12-17H2,1-7H3/t19-,20-,22+,23+,24+,25+,27+,28+,29-/m1/s1

> <SMILES>
C1C[C@H](O)CC2=CC[C@@]3([H])[C@]4([H])CC=C([C@@](O)(C)C[C@@H](C)[C@H](C)C(C)C)[C@@]4(C)CC[C@]3([H])[C@@]12C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 29:2;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
46938955

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
358784

> <CITATION>
-

$$$$