LMFA12000097
  LIPID_MAPS_STRUCTURE_DATABASE

  8  7  0     0  0            999 V2000
   11.6027    7.3436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6793    6.8141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7557    7.3433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8319    6.8141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9082    6.8141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9844    7.3433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.8141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6793    6.0606    0.0000 O   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  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
  2  8  2  0  0  0  0
M  END
> <LM_ID>
LMFA12000097

> <COMMON_NAME>
4Z-Hepten-2-one

> <SYSTEMATIC_NAME>
4Z-Hepten-2-one

> <FORMULA>
C7H12O

> <MASS>
112.09

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Oxygenated hydrocarbons [FA12]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
VQKIKHHXFHNXJT-PLNGDYQASA-N

> <INCHI>
InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h4-5H,3,6H2,1-2H3/b5-4-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
195664

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6431044

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1869865

> <CITATION>
24233565

$$$$