LMST01031057
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0     0  0            999 V2000
   10.9870    7.5393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9816    9.5236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1226    9.0227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1314    8.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8499    9.0324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8462    8.0401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5644    8.0338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5678    9.0267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7106    9.5289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9842    8.5126    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8186   10.0893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6998   10.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5547   10.9790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7119   11.4672    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.3918   10.4916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8452    7.0756    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2777    7.5393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2777    6.5524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1314    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9870    6.5524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4293    8.0291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5810    7.5393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5810    6.5599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4293    6.0701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2777    8.5188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.0701    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5570    9.9038    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9436   10.9695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1314    7.0516    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.9102   10.9672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0698   10.4859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0698    9.5009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2325   10.9731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2325   11.9583    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 33  1  0  0  0  0
 33 31  1  0  0  0  0
 31 30  2  0  0  0  0
  6 16  1  6  0  0  0
  4 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20  1  1  0  0  0  0
 17 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 18  1  0  0  0  0
 17 25  1  1  0  0  0
 23 26  1  1  0  0  0
  9 27  1  6  0  0  0
 12 28  1  6  0  0  0
  4 29  1  6  0  0  0
 31 32  1  0  0  0  0
 33 34  2  0  0  0  0
M  END
> <LM_ID>
LMST01031057

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
cholesta-5,24(28),25-trien-3beta-ol

> <FORMULA>
C28H44O

> <MASS>
396.34

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ALRMOHDSPKRMGT-PXBBAZSNSA-N

> <INCHI>
InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,20,22-26,29H,1,3,7-8,10-17H2,2,4-6H3/t20-,22+,23+,24-,25+,26+,27+,28-/m1/s1

> <SMILES>
[C@]12(CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@]([H])([C@@](C)([H])CCC(=C)C(C)=C)CC[C@@]21[H])[H]

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 28:3;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
128131

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
51814

> <CITATION>
-

$$$$