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> Main
CHEBI:28323 - 3,4-dihydroxycinnamaldehyde
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ChEBI Name
3,4-dihydroxycinnamaldehyde
ChEBI ID
CHEBI:28323
Definition
A cinnamaldehyde that is (
E
)-cinnamaldehyde substituted at positions 3 and 4 on the phenyl ring by hydroxy groups.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
KAX
Secondary ChEBI IDs
CHEBI:3294, CHEBI:22981, CHEBI:75315
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Formula
C9H8O3
Net Charge
0
Average Mass
164.15800
Monoisotopic Mass
164.04734
InChI
InChI=1S/C9H8O3/c10-5-1-2-7-3-4-8(11)9(12)6-7/h1-6,11-12H/b2-1+
InChIKey
AXMVYSVVTMKQSL-OWOJBTEDSA-N
SMILES
Oc1ccc(\C=C\C=O)cc1O
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
3,4-dihydroxycinnamaldehyde (
CHEBI:28323
)
has role
metabolite (
CHEBI:25212
)
3,4-dihydroxycinnamaldehyde (
CHEBI:28323
)
is a
catechols (
CHEBI:33566
)
3,4-dihydroxycinnamaldehyde (
CHEBI:28323
)
is a
cinnamaldehydes (
CHEBI:23245
)
IUPAC Name
(2
E
)-3-(3,4-dihydroxyphenyl)prop-2-enal
Synonyms
Sources
(2
E
)-3-(3,4-dihydroxyphenyl)acrylaldehyde
IUPAC
(
E
)-3,4-dihydroxycinnamaldehyde
ChEBI
(
E
)-caffeyl aldehyde
UniProt
Caffeic aldehyde
KEGG COMPOUND
Caffeyl aldehyde
KEGG COMPOUND
trans
-3,4-dihydroxycinnamaldehyde
ChEBI
Manual Xrefs
Databases
C00007511
KNApSAcK
C10945
KEGG COMPOUND
US2005033090
Patent
View more database links
Registry Number
Type
Source
3127190
Reaxys Registry Number
Reaxys
Citations
Types
Sources
12423886
PubMed citation
Europe PMC
20876124
PubMed citation
Europe PMC
Last Modified
23 April 2015