LMFA07010591
  LIPID_MAPS_STRUCTURE_DATABASE

 24 23  0  0  0  0  0  0  0  0999 V2000
   19.0725    9.5091    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.0725    8.7139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8677    8.0926    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.8677    6.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2051    8.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3377    8.7621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4702    8.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6028    8.7621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7352    8.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8678    8.7621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0004    8.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1329    8.7621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2655    8.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3980    8.7621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5306    8.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6630    8.7621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7956    8.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9281    8.7621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    8.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0003    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1328    6.8961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2653    6.8961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3979    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5305    6.8961    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
  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
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
  4 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010591

> <COMMON_NAME>
(Z)-3-Hexenyl hexadecanoate

> <SYSTEMATIC_NAME>
(Z)-3-Hexenyl hexadecanoate

> <FORMULA>
C22H42O2

> <MASS>
338.32

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(6:1(3Z)/16:0)

> <INCHI_KEY>
IUZMHZICJDXCSE-VURMDHGXSA-N

> <INCHI>
InChI=1S/C22H42O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-20-22(23)24-21-19-8-6-4-2/h6,8H,3-5,7,9-21H2,1-2H3/b8-6-

> <SMILES>
O=C(CCCCCCCCCCCCCCC)OCC/C=C\CC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
180027

> <ABBREVIATION>
WE 22:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
56936004

> <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>
-

> <CITATION>
-

$$$$