CHEBI:186906 - Linalyl cinnamate

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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 Linalyl cinnamate
ChEBI ID CHEBI:186906
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H24O2
Net Charge 0
Average Mass 284.399
Monoisotopic Mass 284.17763
InChI InChI=1S/C19H24O2/c1-5-19(4,15-9-10-16(2)3)21-18(20)14-13-17-11-7-6-8-12-17/h5-8,10-14H,1,9,15H2,2-4H3/b14-13+
InChIKey DPFUEXLIKDHJNB-BUHFOSPRSA-N
SMILES O(C(CCC=C(C)C)(C)C=C)C(=O)/C=C/C1=CC=CC=C1
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing Linalyl cinnamate (CHEBI:186906) is a cinnamate ester (CHEBI:36087)
IUPAC Name
3,7-dimethylocta-1,6-dien-3-yl (E)-3-phenylprop-2-enoate
Manual Xrefs Databases
4511747 ChemSpider
HMDB0030432 HMDB
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Registry Number Type Source
78-37-5 CAS Registry Number ChemIDplus