LMFA01060134
  LIPID_MAPS_STRUCTURE_DATABASE

 23 22  0  0  0  0  0  0  0  0999 V2000
   18.9178    5.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6447    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9178    6.0919    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1856    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4531    5.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7205    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9880    5.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2555    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5229    5.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7904    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0579    5.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3253    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5928    5.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8603    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1277    5.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3952    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6627    5.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9301    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1976    5.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4651    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7325    5.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4531    6.0171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  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 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
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
  5 23  2  0  0  0  0
M  END
> <LM_ID>
LMFA01060134

> <COMMON_NAME>
3-oxo-eicosanoic acid

> <SYSTEMATIC_NAME>
3-oxo-eicosanoic acid

> <FORMULA>
C20H38O3

> <MASS>
326.28

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Oxo fatty acids [FA0106]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MZPZMTFDSVTILM-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(21)18-20(22)23/h2-18H2,1H3,(H,22,23)

> <SMILES>
C(CC(=O)CCCCCCCCCCCCCCCCC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
52350

> <ABBREVIATION>
FA 20:1;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5312922

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$