LMFA01020108
  LIPID_MAPS_STRUCTURE_DATABASE

 16 15  0  0  0  0  0  0  0  0999 V2000
    7.1432    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5722    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8578    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2867    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0013    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7157    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4302    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1448    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8592    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5737    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2883    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5737    6.4850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4288    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7144    5.2476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7157    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 10 12  2  0  0  0  0
 13  1  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
  6 16  1  0  0  0  0
M  END
> <LM_ID>
LMFA01020108

> <COMMON_NAME>
5-methyl-2E-tridecenoic acid

> <SYSTEMATIC_NAME>
5-methyl-2E-tridecenoic 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>
HRQKXMSCZPCUSK-FMIVXFBMSA-N

> <INCHI>
InChI=1S/C14H26O2/c1-3-4-5-6-7-8-10-13(2)11-9-12-14(15)16/h9,12-13H,3-8,10-11H2,1-2H3,(H,15,16)/b12-9+

> <SMILES>
C(CCC)CCCCC(C)C/C=C/C(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
165368

> <ABBREVIATION>
FA 14:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5282656

> <LIPIDBANK_ID>
DFA7076

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$