LMFA07011183
  LIPID_MAPS_STRUCTURE_DATABASE

 12 11  0     0  0            999 V2000
   -0.4310   -0.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4310   -0.7465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4310    0.7465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2993   -0.7465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1679   -0.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0365   -0.7465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9052   -0.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7739   -0.7465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7739   -1.7465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2970   -0.2464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1631   -0.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6391   -0.2450    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  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0     0  0
  2 10  1  0     0  0
 10 11  1  0     0  0
  8 12  2  0     0  0
M  END
> <LM_ID>
LMFA07011183

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
2,4-Hexadienedioic acid 1-ethyl ester

> <FORMULA>
C8H10O4

> <MASS>
170.06

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YBLSYYBXEJACDQ-GGWOSOGESA-N

> <INCHI>
InChI=1S/C8H10O4/c1-2-12-8(11)6-4-3-5-7(9)10/h3-6H,2H2,1H3,(H,9,10)/b5-3+,6-4+

> <SMILES>
C(/C=C/C=C/C(=O)O)(=O)OCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
WE 8:3;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15576075

> <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]; Dicarboxylic acids [FA0117]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
73626

> <CITATION>
-

$$$$