LMFA12000415
  LIPID_MAPS_STRUCTURE_DATABASE

 13 12  0  0  0  0  0  0  0  0999 V2000
   16.6607   -6.4265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7353   -6.9569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8097   -6.4266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8839   -6.9569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9583   -6.4266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0326   -6.9569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1069   -6.4266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1812   -6.9569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2555   -6.4266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7353   -7.7119    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8839   -7.7119    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9583   -5.6714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8822   -5.1381    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  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
  2 10  2  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>
LMFA12000415

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5-ethylnonane-2,4-dione

> <FORMULA>
C11H20O2

> <MASS>
184.15

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Oxygenated hydrocarbons [FA12]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
LOZUOAXDIFHKSF-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C11H20O2/c1-4-6-7-10(5-2)11(13)8-9(3)12/h10H,4-8H2,1-3H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
219276

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
8499

> <CITATION>
16792401

$$$$