EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:84079 - palmityl heptadecanoate

ChEBI IDCHEBI:84079
ChEBI Namepalmityl heptadecanoate
Stars
DefinitionA wax ester resulting from the formal condensation of the carboxy group of heptadecanoic acid with the hydroxy group of palmityl alcohol.
Last Modified26 February 2015
Submitternhn
DownloadsMolfile
FormulaC33H66O2
Net Charge0
Average Mass494.889
Monoisotopic Mass494.50628
SMILESCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCC
InChIInChI=1S/C33H66O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33(34)35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3
InChIKeyVFUQUVNXRJJNEQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
palmityl heptadecanoate (CHEBI:84079) has functional parent heptadecanoic acid (CHEBI:32365)
palmityl heptadecanoate (CHEBI:84079) has functional parent hexadecan-1-ol (CHEBI:16125)
palmityl heptadecanoate (CHEBI:84079) is a wax ester (CHEBI:10036)
IUPAC Name 
hexadecyl heptadecanoate
Synonyms  Source
hexadecyl margarateChEBI
palmityl margarateChEBI
heptadecanoic acid hexadecyl esterChEBI
UniProt Name  Source
hexadecanyl heptadecanoateUniProt
Registry NumbersSources
Reaxys:1806149Reaxys
Citations