LMFA12000019
  LIPID_MAPS_STRUCTURE_DATABASE

  7  6  0  0  0  0  0  0  0  0999 V2000
    8.7609    6.0450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0087    5.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2562    6.0449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5036    5.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0087    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7511    6.0449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.6113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  6  1  0  0  0  0
  2  5  2  0  0  0  0
  6  7  1  0  0  0  0
M  END
> <LM_ID>
LMFA12000019

> <COMMON_NAME>
3E-Hexene-2-one

> <SYSTEMATIC_NAME>
3E-Hexene-2-one

> <FORMULA>
C6H10O

> <MASS>
98.07

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Oxygenated hydrocarbons [FA12]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
LPCWMYHBLXLJJQ-SNAWJCMRSA-N

> <INCHI>
InChI=1S/C6H10O/c1-3-4-5-6(2)7/h4-5H,3H2,1-2H3/b5-4+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5367744

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$