LMFA01060136
  LIPID_MAPS_STRUCTURE_DATABASE

 24 23  0  0  0  0  0  0  0  0999 V2000
   19.6353    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3614    5.5969    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.6353    6.6877    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9039    5.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1721    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4403    5.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7085    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9767    5.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2450    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5132    5.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7814    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0496    5.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3178    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5860    5.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8543    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1225    5.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3907    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6589    5.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9271    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1953    5.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4636    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7318    5.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7318    5.0000    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
 22 23  1  0  0  0  0
 22 24  2  0  0  0  0
M  END
> <LM_ID>
LMFA01060136

> <COMMON_NAME>
20-oxo-heneicosanoic acid

> <SYSTEMATIC_NAME>
20-oxo-heneicosanoic acid

> <FORMULA>
C21H40O3

> <MASS>
340.30

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Oxo fatty acids [FA0106]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MAGPQMMJCMNJQT-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H40O3/c1-20(22)18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21(23)24/h2-19H2,1H3,(H,23,24)

> <SMILES>
C(CCCCCCCCCCCCCCCCCCC(=O)C)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
165430

> <ABBREVIATION>
FA 21:1;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5312924

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$