LMFA12000270
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0  0  0  0  0  0  0  0999 V2000
   20.5803    7.3209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6731    6.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7656    7.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8581    6.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9505    7.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0431    6.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1356    7.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2281    6.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3206    7.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4132    6.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5055    7.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5981    6.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6907    7.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7831    6.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8757    7.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9680    6.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8581    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0431    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.1356    8.0609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0413    8.5838    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
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
  4 18  2  0  0  0  0
  6 19  2  0  0  0  0
  7 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
> <LM_ID>
LMFA12000270

> <COMMON_NAME>
7-Ethylheptadecane-4,6-dione

> <SYSTEMATIC_NAME>
7-Ethylheptadecane-4,6-dione

> <FORMULA>
C19H36O2

> <MASS>
296.27

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Oxygenated hydrocarbons [FA12]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PZVLPNHRVJKPJD-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H36O2/c1-4-7-8-9-10-11-12-13-15-17(6-3)19(21)16-18(20)14-5-2/h17H,4-16H2,1-3H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
196572

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11637954

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
8499

> <CITATION>
16792401

$$$$