LMFA02000242
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0  0  0  0  0  0  0  0999 V2000
   14.2878    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0023    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7168    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4314    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1460    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8605    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1460    6.2376    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5733    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8589    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1444    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4300    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7155    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0011    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2866    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5722    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8577    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1433    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7144    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2878    6.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  5  7  2  0  0  0  0
  2  1  1  0  0  0  0
  1  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 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 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  1 21  2  0  0  0  0
M  END
> <LM_ID>
LMFA02000242

> <COMMON_NAME>
5-keto stearic acid

> <SYSTEMATIC_NAME>
5-oxo-octadecanoic acid

> <FORMULA>
C18H34O3

> <MASS>
298.25

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Other Octadecanoids [FA0200]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
UIROXHXJKJUFSV-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-17(19)15-13-16-18(20)21/h2-16H2,1H3,(H,20,21)

> <SMILES>
C(=O)(CCCCCCCCCCCCC)CCCC(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0034074

> <CHEBI_ID>
172110

> <ABBREVIATION>
FA 18:1;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
85548

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Oxo fatty acids [FA0106]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$