LMST01031022
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0  0  0  0  0  0  0  0999 V2000
    6.5258    6.9328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7487    6.4842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7487    5.5871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5258    5.1384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3027    5.5871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0796    5.1384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8567    5.5871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8567    6.4842    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.0796    6.9328    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.3027    6.4842    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.0796    7.8299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8567    8.2786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6335    7.8299    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.6335    6.9328    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.1874    6.9328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1874    7.8299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4106    8.2786    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.6335    8.5254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3027    7.1124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4106    8.9963    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.6799    9.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0320    9.3551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6536    8.9963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2753    9.3551    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.8967    8.9963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5184    9.3551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8967    8.3905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0836    8.7049    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4106    9.7616    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    5.2662    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2739    9.8707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8567    7.2468    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0627    6.1782    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6335    6.2366    0.0000 H   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 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  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
 17 28  1  6  0  0  0
 20 29  1  1  0  0  0
  3 30  2  0  0  0  0
 24 31  1  1  0  0  0
  8 32  1  1  0  0  0
  9 33  1  6  0  0  0
 14 34  1  6  0  0  0
M  END
> <LM_ID>
LMST01031022

> <COMMON_NAME>
5-campestenone

> <SYSTEMATIC_NAME>
Campest-5-en-3-one

> <FORMULA>
C28H46O

> <MASS>
398.35

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ATIPVUGMJZAJPC-IMUDCKKOSA-N

> <INCHI>
InChI=1S/C28H46O/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/h9,18-20,23-26H,7-8,10-17H2,1-6H3/t19-,20-,23+,24-,25+,26+,27+,28-/m1/s1

> <SMILES>
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@]([H])(C)CC[C@@H](C)C(C)C)CC[C@@]4([H])[C@]3([H])CC=C2CC(=O)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 28:2;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11280982

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$