Ketcher 02202010262D 1   1.00000     0.00000     0

 22 21  0     0  0            999 V2000
   10.4635  -17.5914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2650  -17.0905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1666  -17.5914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0181  -17.0905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8696  -17.5914    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.0181  -16.0887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5619  -17.0905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7105  -17.5914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8589  -17.0905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9573  -17.5914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1059  -17.0905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1059  -16.0887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2384  -15.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2384  -14.5860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1060  -14.0852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1060  -13.0834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9734  -12.5825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8411  -13.0834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7086  -12.5825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5761  -13.0834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4437  -12.5825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3114  -13.0834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  4  6  2  0     0  0
  1  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10 11  2  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  2  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 21 22  1  0     0  0
M  END
> <ID>
CHEBI:146163

> <NAME>
(8Z,11Z,14Z)-icosatrienamide

> <DEFINITION>
A primary fatty amide resulting from the formal condensation of the carboxy group of all-cis-icosa-8,11,14-trienoic acid with ammonia.

> <STAR>
3

> <SYNONYM>
all-cis-icosa-8,11,14-icosatrienamide; all-cis-icosa-8,11,14-eicosatrienamide; (Z,Z,Z)-icosa-8,11,14-trienamide; (8Z,11Z,14Z)-eicosatrienamide

> <IUPAC_NAME>
(8Z,11Z,14Z)-icosa-8,11,14-trienamide

> <FORMULA>
C20H35NO

> <MASS>
305.506

> <MONOISOTOPIC_MASS>
305.27186

> <CHARGE>
0

> <SMILES>
C(CCC(N)=O)CCC/C=C\C/C=C\C/C=C\CCCCC

> <INCHI>
InChI=1S/C20H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H2,21,22)/b7-6-,10-9-,13-12-

> <INCHIKEY>
FEEKQVCOKHTLSP-QNEBEIHSSA-N

> <PUBMED_CITATION>
11128635

$$$$