LMFA07011292
  LIPID_MAPS_STRUCTURE_DATABASE

 31 30  0     0  0            999 V2000
   -0.4001    1.4627    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4001    0.6626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4001    0.0375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4001   -0.8876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3751   -1.4627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2728    0.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1456    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0185    0.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8913    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7641    0.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6370    0.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5098    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3827    0.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2555    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1283    0.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0012    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8740    0.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7469    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6197    0.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4925    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3654    0.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2473   -0.9240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1202   -1.4627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9930   -0.9240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8658   -1.4627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7387   -0.9240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6115   -1.4627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4844   -0.9240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3572   -1.4627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2300   -0.9240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1029   -1.4627    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
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
  5 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  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
M  END
> <LM_ID>
LMFA07011292

> <COMMON_NAME>
WE 12:0/17:1(6Z)

> <SYSTEMATIC_NAME>
Dodecanyl 6Z-heptadecenoate

> <FORMULA>
C29H56O2

> <MASS>
436.43

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PBFQNMIIUMGQFU-HNENSFHCSA-N

> <INCHI>
InChI=1S/C29H56O2/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29(30)31-28-26-24-22-20-14-12-10-8-6-4-2/h18-19H,3-17,20-28H2,1-2H3/b19-18-

> <SMILES>
O=C(CCCC/C=C\CCCCCCCCCC)OCCCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
WE 29:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
178328247

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9606

> <CITATION>
38556723

$$$$