CHEBI:194238 - trans-3-hexenyl isovalerate

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ChEBI Name trans-3-hexenyl isovalerate
ChEBI ID CHEBI:194238
ChEBI ASCII Name trans-3-hexenyl isovalerate
Definition A 3-hexenyl isovalerate in which the double bond adopts trans-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C11H20O2
Net Charge 0
Average Mass 184.279
Monoisotopic Mass 184.14633
InChI InChI=1S/C11H20O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h5-6,10H,4,7-9H2,1-3H3/b6-5+
InChIKey AIQLNKITFBJPFO-AATRIKPKSA-N
SMILES CC\C=C\CCOC(=O)CC(C)C
Metabolite of Species Details
Camellia sinensis (NCBI:txid4442) See: PubMed
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.
(via 3-hexenyl isovalerate )
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
(via 3-hexenyl isovalerate )
Application(s): flavouring agent
A food additive that is used to added improve the taste or odour of a food.
(via 3-hexenyl isovalerate )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing trans-3-hexenyl isovalerate (CHEBI:194238) has role plant metabolite (CHEBI:76924)
trans-3-hexenyl isovalerate (CHEBI:194238) is a 3-hexenyl isovalerate (CHEBI:194237)
IUPAC Name
(3E)-hex-3-en-1-yl 3-methylbutanoate
Synonyms Sources
(3E)-3-hexenyl 3-methylbutanoate ChEBI
(3E)-hex-3-enyl 3-methylbutyrate ChEBI
(3E)-hex-3-enyl isovalerate ChEBI
(3E)-hexenyl 3-methyl butyrate ChEBI
(3E)-hexenyl isovalerate ChEBI
(E)-3-hexen-1-yl isovalerate ChEBI
(E)-3-hexenyl 3-methylbutanoate ChEBI
(E)-3-hexenyl 3-methylbutyrate ChEBI
(E)-3-hexenyl isopentanoate ChEBI
(E)-3-hexenyl isovalerate ChEBI
(E)-hex-3-en-1-yl 3-methylbutanoate ChEBI
(E)-hex-3-enyl 3-methylbutanoate ChEBI
(E)-hex-3-enyl 3-methylbutyrate ChEBI
(E)-hex-3-enyl isovalerate ChEBI
3-methylbutanoic acid (3E)-3-hexen-1-yl ester ChEBI
3-methylbutanoic acid (E)-3-hexenyl ester ChEBI
[(E)-hex-3-enyl] 3-methylbutanoate ChEBI
isovaleric acid trans-3-hexenyl ester ChEBI
trans-3-hexenyl 3-methylbutanoate ChEBI
trans-3-hexenyl 3-methylbutyrate ChEBI
trans-3-hexenyl isopentanoate ChEBI
trans-hex-3-enyl 3-methylbutanoate ChEBI
trans-hex-3-enyl 3-methylbutyrate ChEBI
trans-hex-3-enyl isovalerate ChEBI
Manual Xref Database
4825609 ChemSpider
View more database links
Registry Numbers Types Sources
32652697 Reaxys Registry Number Reaxys
88296-26-8 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
31478003 PubMed citation Europe PMC
31505888 PubMed citation Europe PMC
Last Modified
13 January 2023