CHEBI:165697 - Oleyl behenate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Oleyl behenate
ChEBI ID CHEBI:165697
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C40H78O2
Net Charge 0
Average Mass 591.062
Monoisotopic Mass 590.60018
InChI InChI=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-
InChIKey AOXNDJKHXBKZBT-ZZEZOPTASA-N
SMILES O(CCCCCCCC/C=C\CCCCCCCC)C(=O)CCCCCCCCCCCCCCCCCCCCC
ChEBI Ontology
Outgoing Oleyl behenate (CHEBI:165697) is a wax ester (CHEBI:10036)
IUPAC Name
[(Z)-octadec-9-enyl] docosanoate
Manual Xrefs Databases
4941685 ChemSpider
LMFA07010173 LIPID MAPS
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Registry Number Type Source
66161-52-2 CAS Registry Number ChemIDplus