LMFA03000038
  LIPID_MAPS_STRUCTURE_DATABASE

 23 22  0     0  0            999 V2000
   -0.4419   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4419   -0.7654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4419    0.7654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3322   -0.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2229   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1135   -0.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0042   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8949   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7856   -0.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6763   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5670   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4576   -0.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3483   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2390   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1297   -0.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0204   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9110   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8017   -0.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.6924   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.5831   -0.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.4738   -0.2552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.3644   -0.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.4738    0.7448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  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  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  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
 21 23  2  0     0  0
M  END
> <LM_ID>
LMFA03000038

> <COMMON_NAME>
19-oxo-arachidonic acid

> <SYSTEMATIC_NAME>
19-oxo-eicosa-5Z,8Z,11Z,14Z-tetraenoic acid

> <FORMULA>
C20H30O3

> <MASS>
318.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Other Eicosanoids [FA0300]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
19-keto-arachidonic acid

> <INCHI_KEY>
KUPSOFRTWMTZDX-TWVHMNNTSA-N

> <INCHI>
InChI=1S/C20H30O3/c1-19(21)17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20(22)23/h3-6,9-12H,2,7-8,13-18H2,1H3,(H,22,23)/b5-3-,6-4-,11-9-,12-10-

> <SMILES>
C(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)C)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 20:5;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11151306

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Oxo fatty acids [FA0106]; Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
9986

> <CITATION>
6792198

$$$$