LMFA01030241
  LIPID_MAPS_STRUCTURE_DATABASE

 14 13  0  0  0  0  0  0  0  0999 V2000
   13.0028    5.6644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7247    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0028    6.3320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2756    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5480    5.6644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8205    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0929    5.6644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3653    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6378    5.6644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9102    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1827    5.6644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4551    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7276    5.6644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.2475    0.0000 C   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  2  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  2  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  2  0  0  0  0
 13 14  1  0  0  0  0
M  END
> <LM_ID>
LMFA01030241

> <COMMON_NAME>
2E,6E,8E,10E-dodecatetraenoic acid

> <SYSTEMATIC_NAME>
2E,6E,8E,10E-dodecatetraenoic acid

> <FORMULA>
C12H16O2

> <MASS>
192.12

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
C12:4n-2,4,6,10

> <INCHI_KEY>
ASTBWPMXGJCVAM-IFZPDKMOSA-N

> <INCHI>
InChI=1S/C12H16O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-7,10-11H,8-9H2,1H3,(H,13,14)/b3-2+,5-4+,7-6+,11-10+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
179917

> <ABBREVIATION>
FA 12:4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5312393

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$