CHEBI:133316 - caffeic acid quinone

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ChEBI Name caffeic acid quinone
Definition An α,β-unsaturated monocarboxylic acid that is acrylic acid in which one of the olefinic hydrogens at position 3 has been replaced by a 3,4-dioxocyclohexa-1,5-dien-1-yl group.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:80759
Supplier Information
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Formula C9H6O4
Net Charge 0
Average Mass 178.142
Monoisotopic Mass 178.02661
InChI InChI=1S/C9H6O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5H,(H,12,13)/b4-2+
Metabolite of Species Details
Glycine max (NCBI:txid3847) See: MetaboLights Study
Glycine max (NCBI:txid3847) See: PubMed
Glycine max (NCBI:txid3847) See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing caffeic acid quinone (CHEBI:133316) has functional parent acrylic acid (CHEBI:18308)
caffeic acid quinone (CHEBI:133316) has role plant metabolite (CHEBI:76924)
caffeic acid quinone (CHEBI:133316) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
caffeic acid quinone (CHEBI:133316) is a 1,2-benzoquinones (CHEBI:132123)
(2E)-3-(3,4-dioxocyclohexa-1,5-dien-1-yl)prop-2-enoic acid
Synonyms Sources
3-(2-propenoic acid)-o-benzoquinone ChEBI
3-(3,4-dioxocyclohexa-1,5-dien-1-yl)acrylic acid ChEBI
caffeic acid o-quinone ChEBI
caffeoquinone ChEBI
Manual Xrefs Databases
24785041 ChemSpider
View more database links
Registry Number Type Source
2718010 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
10552861 PubMed citation Europe PMC
15893932 PubMed citation Europe PMC
2356237 PubMed citation Europe PMC
7586086 PubMed citation Europe PMC
IND20384788 Agricola citation Europe PMC
IND23278687 Agricola citation Europe PMC
IND87016065 Agricola citation Europe PMC
Last Modified
17 February 2017