CHEBI:171774 - Neryl butyrate

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ChEBI Name Neryl butyrate
ChEBI ID CHEBI:171774
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C14H24O2
Net Charge 0
Average Mass 224.344
Monoisotopic Mass 224.17763
InChI InChI=1S/C14H24O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,10H,5-7,9,11H2,1-4H3/b13-10-
InChIKey ZSBOMYJPSRFZAL-RAXLEYEMSA-N
SMILES O(C/C=C(\CCC=C(C)C)/C)C(=O)CCC
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in Pooled sample (NCIT:C45910). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing Neryl butyrate (CHEBI:171774) is a carboxylic ester (CHEBI:33308)
IUPAC Name
[(2Z)-3,7-dimethylocta-2,6-dienyl] butanoate
Manual Xrefs Databases
4509113 ChemSpider
HMDB0038259 HMDB
LMFA07010626 LIPID MAPS
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Registry Number Type Source
999-40-6 CAS Registry Number ChemIDplus