LMFA07011422
  LIPID_MAPS_STRUCTURE_DATABASE

 37 36  0     0  0            999 V2000
   -0.3996    1.4611    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3996    0.6619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3996    0.0374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3996   -0.8866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3747   -1.4611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2713    0.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1432    0.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0150    0.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8869    0.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7587    0.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6306    0.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5024    0.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3743    0.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2461    0.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1180    0.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9898    0.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8617    0.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7335    0.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2459   -0.9230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1178   -1.4611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9896   -0.9230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8615   -1.4611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7333   -0.9230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6052   -1.4611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4770   -0.9230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3489   -1.4611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2207   -0.9230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0926   -1.4611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9644   -1.4611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8363   -0.9230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7081   -1.4611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5800   -0.9230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4518   -1.4611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3237   -0.9230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1955   -1.4611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.0674   -0.9230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.9392   -1.4611    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
  2  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  2  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
  5 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
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
M  END
> <LM_ID>
LMFA07011422

> <COMMON_NAME>
WE 21:1(12Z)/14:1(6Z)

> <SYSTEMATIC_NAME>
12Z-Heneicosenyl 6Z-tetradecenoate

> <FORMULA>
C35H66O2

> <MASS>
518.51

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FMPNSVHYUGYFPQ-XSOAJACLSA-N

> <INCHI>
InChI=1S/C35H66O2/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-26-28-30-32-34-37-35(36)33-31-29-27-25-23-14-12-10-8-6-4-2/h16-17,23,25H,3-15,18-22,24,26-34H2,1-2H3/b17-16-,25-23-

> <SMILES>
O=C(CCCC/C=C\CCCCCCC)OCCCCCCCCCCC/C=C\CCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
WE 35:2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
-

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9606

> <CITATION>
38556723

$$$$