LMFA07010565
  LIPID_MAPS_STRUCTURE_DATABASE

 28 27  0     0  0            999 V2000
   21.8100    9.5216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8100    8.7233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6083    8.0994    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.6083    6.9344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9392    8.2595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0682    8.7717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1973    8.2595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3263    8.7717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1973    7.2616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.7375    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8666    6.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9957    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1246    6.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2537    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3828    6.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5119    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6409    6.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7700    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8991    6.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0281    6.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1572    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2862    6.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4153    6.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5444    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6735    6.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8024    6.8982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9315    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.8982    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
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  4 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  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010565

> <COMMON_NAME>
(Z,Z,Z)-11,14,17-Eicosatrienyl 4-methylvalerate

> <SYSTEMATIC_NAME>
(Z,Z,Z)-11,14,17-Eicosatrienyl 4-methylvalerate

> <FORMULA>
C26H46O2

> <MASS>
390.35

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(20:3(11Z,14Z,17Z)/5:0(4Me))

> <INCHI_KEY>
ACYOLBBKHJUMSO-AGRJPVHOSA-N

> <INCHI>
InChI=1S/C26H46O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-28-26(27)23-22-25(2)3/h5-6,8-9,11-12,25H,4,7,10,13-24H2,1-3H3/b6-5-,9-8-,12-11-

> <SMILES>
O=C(CCC(C)C)OCCCCCCCCCC/C=C\C/C=C\C/C=C\CC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
187175

> <ABBREVIATION>
WE 26:3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
56935998

> <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>
Unsaturated fatty acids [FA0103]; Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
2249548

> <CITATION>
-

$$$$