EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:170095 - Ethyl 2E,4Z-hexadecadienoate

ChEBI IDCHEBI:170095
ChEBI NameEthyl 2E,4Z-hexadecadienoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O2
Net Charge0
Average Mass280.452
Monoisotopic Mass280.24023
SMILESCCCCCCCCCCC/C=C\C=C\C(=O)OCC
InChIInChI=1S/C18H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-4-2/h14-17H,3-13H2,1-2H3/b15-14-,17-16+
InChIKeyQUHRGXQJTPAPQQ-PEMGLXIVSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
Ethyl 2E,4Z-hexadecadienoate (CHEBI:170095) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
ethyl (2E,4Z)-hexadeca-2,4-dienoate
Manual XrefsDatabases
30776876ChemSpider
HMDB0031051HMDB