LMFA02000393
  LIPID_MAPS_STRUCTURE_DATABASE

 22 21  0     0  0            999 V2000
   16.6726   -3.3773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5462   -3.8817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.6726   -2.3683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7923   -3.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9117   -3.3773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0313   -3.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1508   -3.3773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2703   -3.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3896   -3.3773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5091   -3.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6287   -3.3773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7481   -3.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8676   -3.3773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9872   -3.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1065   -3.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2260   -3.3773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3455   -3.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4650   -3.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5843   -3.3773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7039   -3.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6287   -2.3773    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7481   -4.8817    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  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  2  0     0  0
 15 16  1  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
 11 21  1  0     0  0
 12 22  2  0     0  0
M  END
> <LM_ID>
LMFA02000393

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
9-hydroxy-10-oxo-12(Z),15(Z)-octadecadienoic acid

> <FORMULA>
C18H30O4

> <MASS>
310.21

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Other Octadecanoids [FA0200]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
DODA; FIF; flower-inducing factor

> <INCHI_KEY>
NJAYHLDXCVDTEV-ZJSQCTGTSA-N

> <INCHI>
InChI=1S/C18H30O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h3-4,7,10,17,20H,2,5-6,8-9,11-15H2,1H3,(H,21,22)/b4-3-,10-7-

> <SMILES>
C(CCCCCCCC(O)C(=O)C/C=C\C/C=C\CC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:3;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11243846

> <LIPIDBANK_ID>
-

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

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

> <ALT_SUB_CLASSES>
Hydroxy fatty acids [FA0105]; Oxo fatty acids [FA0106]; Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-; -; -

> <TAXONOMY>
89585

> <CITATION>
10750715

$$$$