LMFA02000293
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0     0  0            999 V2000
   -0.4367   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4367   -0.7563    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4367    0.7563    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3164   -0.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1966   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0767   -0.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9569   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8372   -0.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7173   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5975   -0.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4776   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3578   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2379   -0.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1181   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9982   -0.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8784   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7585   -0.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6388   -0.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5189   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.3991   -0.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0767   -1.7648    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  1  3  2  0     0  0
  1  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 11 12  2  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  2  0     0  0
 16 17  1  0     0  0
 17 18  2  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
  6 21  2  0     0  0
M  END
> <LM_ID>
LMFA02000293

> <COMMON_NAME>
Chrysobalanic acid

> <SYSTEMATIC_NAME>
4-oxo-octa-deca-9Z,11E,13E,15Z-tetraenoic acid

> <FORMULA>
C18H26O3

> <MASS>
290.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Other Octadecanoids [FA0200]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZYOSGENSARGRME-ZSCYQOFPSA-N

> <INCHI>
InChI=1S/C18H26O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19)15-16-18(20)21/h3-10H,2,11-16H2,1H3,(H,20,21)/b4-3-,6-5+,8-7+,10-9-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
187125

> <ABBREVIATION>
FA 18:5;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
131839804

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

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
22978

> <CITATION>
-

$$$$