LMFA06000120
  LIPID_MAPS_STRUCTURE_DATABASE

  9  8  0     0  0            999 V2000
   10.6891    7.6462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6077    7.1157    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6891    8.4956    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7636    7.1157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8379    7.6461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9121    7.1157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9863    7.6461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    7.1157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9121    6.3605    0.0000 O   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
  6  9  2  0  0  0  0
M  END
> <LM_ID>
LMFA06000120

> <COMMON_NAME>
4-oxo-2E-Hexenal

> <SYSTEMATIC_NAME>
4-oxo-2E-Hexenal

> <FORMULA>
C6H8O2

> <MASS>
112.05

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty aldehydes [FA06]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GVKYFODEMNCLGS-ONEGZZNKSA-N

> <INCHI>
InChI=1S/C6H8O2/c1-2-6(8)4-3-5-7/h3-5H,2H2,1H3/b4-3+

> <SMILES>
C(/C=C/C(=O)CC)(=O)[H]

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0031759

> <CHEBI_ID>
76721

> <ABBREVIATION>
FAL 6:2;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6365145

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
191327

> <CITATION>
-

$$$$