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CHEBI:84932 - ethyl hexadecanoate

ChEBI IDCHEBI:84932
ChEBI Nameethyl hexadecanoate
Stars
DefinitionA long-chain fatty acid ethyl ester resulting from the formal condensation of the carboxy group of palmitic acid with the hydroxy group of ethanol.
Last Modified30 May 2016
Submitternamrata
DownloadsMolfile
FormulaC18H36O2
Net Charge0
Average Mass284.484
Monoisotopic Mass284.27153
SMILESCCCCCCCCCCCCCCCC(=O)OCC
InChIInChI=1S/C18H36O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-4-2/h3-17H2,1-2H3
InChIKeyXIRNKXNNONJFQO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Cyperus esculentus (ncbitaxon:1053340) - PubMed (22936608)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
ethyl hexadecanoate (CHEBI:84932) has role plant metabolite (CHEBI:76924)
ethyl hexadecanoate (CHEBI:84932) is a hexadecanoate ester (CHEBI:25835)
ethyl hexadecanoate (CHEBI:84932) is a long-chain fatty acid ethyl ester (CHEBI:13209)
IUPAC Name 
ethyl hexadecanoate
Synonyms  Source
WE(2:0/16:0)LIPID MAPS
Palmitic acid ethyl esterHMDB
Ethyl cetylateChemIDplus
ethyl palmitateChEBI
UniProt Name  Source
ethyl hexadecanoateUniProt
Manual XrefsDatabases
LMFA07010471LIPID MAPS
HMDB0029811HMDB
Registry NumbersSources
Reaxys:1782663Reaxys
CAS:628-97-7NIST Chemistry WebBook
CAS:628-97-7ChemIDplus
Citations