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CHEBI:179719 - hexadecyl butyrate

ChEBI IDCHEBI:179719
ChEBI Namehexadecyl butyrate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H40O2
Net Charge0
Average Mass312.538
Monoisotopic Mass312.30283
SMILESCCCCCCCCCCCCCCCCOC(=O)CCC
InChIInChI=1S/C20H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-20(21)18-4-2/h3-19H2,1-2H3
InChIKeyNJVKAQGGBANCKG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
hexadecyl butyrate (CHEBI:179719) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
hexadecyl butanoate
Manual XrefsDatabases
455381ChemSpider
LMFA07010428LIPID MAPS
Registry NumbersSources
CAS:6221-99-4ChemIDplus