LMFA02000253
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0  0  0  0  0  0  0  0999 V2000
   16.9263    6.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6660    5.6080    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9263    6.7191    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1812    5.6080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4358    6.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6904    5.6080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9450    6.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1996    5.6080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4542    6.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7087    5.6080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9633    6.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2179    5.6080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4725    6.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7271    5.6080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9817    6.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2362    5.6080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4908    6.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7454    5.6080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2179    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7454    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  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
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 12 20  2  0  0  0  0
 18 21  1  0  0  0  0
M  END
> <LM_ID>
LMFA02000253

> <COMMON_NAME>
16-methyl-10-oxo-heptadecanoic acid

> <SYSTEMATIC_NAME>
16-methyl-10-oxo-heptadecanoic acid

> <FORMULA>
C18H34O3

> <MASS>
298.25

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Other Octadecanoids [FA0200]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DXSQWDXMGNYMDL-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H34O3/c1-16(2)12-8-7-10-14-17(19)13-9-5-3-4-6-11-15-18(20)21/h16H,3-15H2,1-2H3,(H,20,21)

> <SMILES>
C(CCCCCCCCC(=O)CCCCCC(C)C)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
179228

> <ABBREVIATION>
FA 18:1;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5312899

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Branched fatty acids [FA0102]; Oxo fatty acids [FA0106]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$