5363265
  CDK     0829231231

 20 19  0  0  0  0  0  0  0  0999 V2000
    3.0790   -0.8745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645   -2.1120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9370   -0.8745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2224   -1.2870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6515   -1.2870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5080   -0.8745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3659   -0.8745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7935   -1.2870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0804   -1.2870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7949   -0.0495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7949   -0.8745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5094    0.3630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6529    1.6005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9383    1.1880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3674    1.1880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5094    1.1880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2239    1.6005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0818    1.6005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645   -1.2870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -0.8745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0 
  1 19  1  0  0  0  0 
  2 19  2  0  0  0  0 
  3  4  1  0  0  0  0 
  3  5  1  0  0  0  0 
  4  6  1  0  0  0  0 
  5  7  1  0  0  0  0 
  6  8  1  0  0  0  0 
  7  9  1  0  0  0  0 
  9 11  2  0  0  0  0 
 10 11  1  0  0  0  0 
 10 12  1  0  0  0  0 
 12 16  1  0  0  0  0 
 13 14  1  0  0  0  0 
 13 15  1  0  0  0  0 
 14 17  1  0  0  0  0 
 15 18  1  0  0  0  0 
 16 17  2  0  0  0  0 
 19 20  1  0  0  0  0 
M  END
> <ID>
CHEBI:196500

> <NAME>
7Z,11Z-Hexadecadienyl acetate

> <STAR>
2

> <IUPAC_NAME>
[(7Z,11Z)-hexadeca-7,11-dienyl] acetate

> <FORMULA>
C18H32O2

> <MASS>
280.452

> <MONOISOTOPIC_MASS>
280.24023

> <CHARGE>
0

> <SMILES>
O(CCCCCC/C=C\CC/C=C\CCCC)C(=O)C

> <INCHI>
InChI=1S/C18H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h6-7,10-11H,3-5,8-9,12-17H2,1-2H3/b7-6-,11-10-

> <INCHIKEY>
BXJHOKLLMOYSRQ-QOXWLJPHSA-N

> <LIPID_MAPS_INSTANCE_ACCESSION>
LMFA07010375

$$$$