LMFA07010442
  LIPID_MAPS_STRUCTURE_DATABASE

 22 21  0     0  0            999 V2000
   16.4830    8.9789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4830    8.1807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2811    7.5571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2811    6.6344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5079    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6378    6.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7673    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8966    6.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0259    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1552    6.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2846    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4139    6.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5432    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6727    6.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8020    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9313    6.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6125    7.7170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7418    8.2290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8711    7.7170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0005    8.2290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1298    7.7170    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
  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
  2 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010442

> <COMMON_NAME>
WE 14:0/6:0

> <SYSTEMATIC_NAME>
tetradecyl hexanoate

> <FORMULA>
C20H40O2

> <MASS>
312.30

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(14:0/6:0)

> <INCHI_KEY>
SMMNCBBCUVMKHP-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H40O2/c1-3-5-7-8-9-10-11-12-13-14-15-17-19-22-20(21)18-16-6-4-2/h3-19H2,1-2H3

> <SMILES>
O=C(CCCCC)OCCCCCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
179716

> <ABBREVIATION>
WE 20:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
539151

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
48719

> <CITATION>
-

$$$$