CHEBI:78334 - (R)-linalyl acetate

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ChEBI Name (R)-linalyl acetate
ChEBI ID CHEBI:78334
ChEBI ASCII Name (R)-linalyl acetate
Definition The (R)-enantiomer of linalyl acetate.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C12H20O2
Net Charge 0
Average Mass 196.28600
Monoisotopic Mass 196.146
InChI InChI=1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3/t12-/m0/s1
InChIKey UWKAYLJWKGQEPM-LBPRGKRZSA-N
SMILES CC(C)=CCC[C@@](C)(OC(C)=O)C=C
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
volatile oil component
Any plant metabolite that is found naturally as a component of a volatile oil.
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ChEBI Ontology
Outgoing (R)-linalyl acetate (CHEBI:78334) has role plant metabolite (CHEBI:76924)
(R)-linalyl acetate (CHEBI:78334) has role volatile oil component (CHEBI:27311)
(R)-linalyl acetate (CHEBI:78334) is a 3,7-dimethylocta-1,6-dien-3-yl acetate (CHEBI:78333)
(R)-linalyl acetate (CHEBI:78334) is enantiomer of (S)-linalyl acetate (CHEBI:78335)
Incoming linalyl acetate (CHEBI:6469) has part (R)-linalyl acetate (CHEBI:78334)
(S)-linalyl acetate (CHEBI:78335) is enantiomer of (R)-linalyl acetate (CHEBI:78334)
IUPAC Name
(3R)-3,7-dimethylocta-1,6-dien-3-yl acetate
Synonym Source
(−)-linalyl acetate ChemIDplus
Manual Xrefs Databases
C00003048 KNApSAcK
C09863 KEGG COMPOUND
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Registry Numbers Types Sources
115-95-7 CAS Registry Number KEGG COMPOUND
16509-46-9 CAS Registry Number ChemIDplus
1724499 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
20420305 PubMed citation Europe PMC
Last Modified
28 July 2014