LMFA07010093
  LIPID_MAPS_STRUCTURE_DATABASE

 32 31  0  0  0  0  0  0  0  0999 V2000
   17.3478    7.6820    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3478    7.0162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0136    6.4959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0136    5.7261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3686    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6427    5.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9164    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1900    5.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4637    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7373    5.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0110    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2846    5.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5583    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8320    5.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1056    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6215    6.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8952    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1688    6.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4425    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7162    6.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9898    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2635    6.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5371    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8108    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0844    6.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3581    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6317    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9054    6.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1790    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4527    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7263    6.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.0565    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
  2 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
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010093

> <COMMON_NAME>
Lauryl linolenate

> <SYSTEMATIC_NAME>
dodecanyl 9Z,12Z,15Z-octadecatrienoate

> <FORMULA>
C30H54O2

> <MASS>
446.41

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(12:0/18:3(9Z,12Z,15Z)); dodecyl 9Z,12Z,15Z-octadecatrienoate

> <INCHI_KEY>
OJUWCMVWZKGKMF-YYPVPKODSA-N

> <INCHI>
InChI=1S/C30H54O2/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-26-28-30(31)32-29-27-25-23-21-14-12-10-8-6-4-2/h5,7,11,13,16-17H,3-4,6,8-10,12,14-15,18-29H2,1-2H3/b7-5-,13-11-,17-16-

> <SMILES>
O=C(CCCCCCC/C=C\C/C=C\C/C=C\CC)OCCCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
165653

> <ABBREVIATION>
WE 30:3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
56935926

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32644

> <CITATION>
22058425

$$$$