LMFA12000411
  LIPID_MAPS_STRUCTURE_DATABASE

 13 12  0  0  0  0  0  0  0  0999 V2000
   16.5753   -6.5348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6670   -7.0554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7585   -6.5350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8495   -7.0554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9412   -6.5350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0326   -7.0554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1239   -6.5350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2153   -7.0554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3068   -6.5350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3982   -7.0554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8495   -7.7965    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9412   -5.7940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6815   -5.0535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  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  1  0  0  0  0
  9 10  1  0  0  0  0
  4 11  2  0  0  0  0
  5 12  1  0  0  0  0
 12 13  1  0  0  0  0
M  END
> <LM_ID>
LMFA12000411

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5-Ethyl-2E-decen-4-one

> <FORMULA>
C12H22O

> <MASS>
182.17

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Oxygenated hydrocarbons [FA12]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HPXBVXXYUWZMOY-WEVVVXLNSA-N

> <INCHI>
InChI=1S/C12H22O/c1-4-7-8-10-11(6-3)12(13)9-5-2/h5,9,11H,4,6-8,10H2,1-3H3/b9-5+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11665507

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
8499

> <CITATION>
16792401

$$$$