CHEBI:171776 - Linalyl isobutyrate

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ChEBI Name Linalyl isobutyrate
ChEBI ID CHEBI:171776
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/c1-7-14(6,10-8-9-11(2)3)16-13(15)12(4)5/h7,9,12H,1,8,10H2,2-6H3
InChIKey JZIARAQCPRDGAC-UHFFFAOYSA-N
SMILES O(C(CCC=C(C)C)(C)C=C)C(=O)C(C)C
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 Linalyl isobutyrate (CHEBI:171776) is a monoterpenoid (CHEBI:25409)
IUPAC Name
3,7-dimethylocta-1,6-dien-3-yl 2-methylpropanoate
Manual Xrefs Databases
6284 ChemSpider
HMDB0030426 HMDB
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Registry Number Type Source
78-35-3 CAS Registry Number ChemIDplus