LMFA01020464
  LIPID_MAPS_STRUCTURE_DATABASE

 16 15  0  0  0  0  0  0  0  0999 V2000
   15.5945   -5.8871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4565   -6.3847    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5945   -4.8918    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7262   -6.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8576   -5.8871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9890   -6.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1203   -5.8871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2516   -6.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3829   -5.8871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5143   -6.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6456   -5.8871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7770   -6.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7263   -7.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8603   -7.8848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9126   -5.8818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0449   -6.3788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  1  3  2  0     0  0
  1  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
  4 13  1  0     0  0
 13 14  1  0     0  0
 12 15  1  0     0  0
 15 16  1  0     0  0
M  END
> <LM_ID>
LMFA01020464

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
2-ethyl-dodec-2E-enoic acid

> <FORMULA>
C14H26O2

> <MASS>
226.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Branched fatty acids [FA0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
LYGBSRYRPAAODJ-OUKQBFOZSA-N

> <INCHI>
InChI=1S/C14H26O2/c1-3-5-6-7-8-9-10-11-12-13(4-2)14(15)16/h12H,3-11H2,1-2H3,(H,15,16)/b13-12+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 14:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
-

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9685

> <CITATION>
42617604

$$$$