LMFA07010679
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0     0  0            999 V2000
   16.4226    9.1730    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4226    8.3869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2088    7.7726    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2088    6.6256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5653    7.9302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7076    8.4346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5653    6.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3513    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4938    6.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6362    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7786    6.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9212    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0635    6.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2059    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3484    6.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4908    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6332    6.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7757    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9182    6.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  4  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
 19 20  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010679

> <COMMON_NAME>
SFE 14:0/3:0(2Me)

> <SYSTEMATIC_NAME>
Tetradecyl isobutyrate

> <FORMULA>
C18H36O2

> <MASS>
284.27

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(14:0/3:0(2Me))

> <INCHI_KEY>
CFSDKUROIWNCSH-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H36O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-18(19)17(2)3/h17H,4-16H2,1-3H3

> <SMILES>
O=C(C(C)C)OCCCCCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
196212

> <ABBREVIATION>
WE 18:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
560579

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
41704

> <CITATION>
-

$$$$