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CHEBI:165697 - Oleyl behenate

ChEBI IDCHEBI:165697
ChEBI NameOleyl behenate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC40H78O2
Net Charge0
Average Mass591.062
Monoisotopic Mass590.60018
SMILESCCCCCCCC/C=C\CCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C40H78O2/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-40(41)42-39-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h18,20H,3-17,19,21-39H2,1-2H3/b20-18-
InChIKeyAOXNDJKHXBKZBT-ZZEZOPTASA-N
ChEBI Ontology
Outgoing Relation(s)
Oleyl behenate (CHEBI:165697) is a wax ester (CHEBI:10036)
IUPAC Name 
[(Z)-octadec-9-enyl] docosanoate
Manual XrefsDatabases
4941685ChemSpider
LMFA07010173LIPID MAPS
Registry NumbersSources
CAS:66161-52-2ChemIDplus