LMFA01030796
  LIPID_MAPS_STRUCTURE_DATABASE

 10  9  0  0  0  0  0  0  0  0999 V2000
    8.5884    6.4810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3006    6.0698    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5884    7.3034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8710    6.0698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1533    6.4810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4355    6.0698    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.7178    6.4810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8710    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4355    5.2475    0.0000 C   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  1  0  0  0  0
  7  8  1  0  0  0  0
  4  9  1  0  0  0  0
  6 10  1  0  0  0  0
M  END
> <LM_ID>
LMFA01030796

> <COMMON_NAME>
2,4-Dimethyl-2-hexenoic acid

> <SYSTEMATIC_NAME>
2,4-Dimethyl-2-hexenoic acid

> <FORMULA>
C8H14O2

> <MASS>
142.10

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DCELYZLYGOHVMN-FNORWQNLSA-N

> <INCHI>
InChI=1S/C8H14O2/c1-4-6(2)5-7(3)8(9)10/h5-6H,4H2,1-3H3,(H,9,10)/b7-5+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
180311

> <ABBREVIATION>
FA 8:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12723513

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$