LMFA01060056
  LIPID_MAPS_STRUCTURE_DATABASE

 19 18  0  0  0  0  0  0  0  0999 V2000
   12.8588    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5734    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2879    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0025    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7170    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4316    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7170    6.2376    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1444    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4299    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7155    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0010    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2866    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5722    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8577    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1433    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7144    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0010    6.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  5  7  2  0  0  0  0
  2  1  1  0  0  0  0
  1  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
 17 18  1  0  0  0  0
 11 19  2  0  0  0  0
M  END
> <LM_ID>
LMFA01060056

> <COMMON_NAME>
9-keto palmitic acid

> <SYSTEMATIC_NAME>
9-oxo-hexadecanoic acid

> <FORMULA>
C16H30O3

> <MASS>
270.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Oxo fatty acids [FA0106]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KHCDPAZLBSPVSE-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C16H30O3/c1-2-3-4-6-9-12-15(17)13-10-7-5-8-11-14-16(18)19/h2-14H2,1H3,(H,18,19)

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0030973

> <CHEBI_ID>
174564

> <ABBREVIATION>
FA 16:1;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283002

> <LIPIDBANK_ID>
DFA0440

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$