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CHEBI:16547 - coniferyl aldehyde
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ChEBI Name
coniferyl aldehyde
ChEBI ID
CHEBI:16547
Definition
A member of the class of cinnamaldehydes that is cinnamaldehyde substituted by a hydroxy group at position 4 and a methoxy group at position 3.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:23372, CHEBI:3859, CHEBI:14018
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Formulae
C10H10O3
C10H10O3
Net Charge
0
Average Mass
178.18460
Monoisotopic Mass
178.06299
InChI
InChI=1S/C10H10O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-7,12H,1H3/b3-2+
InChIKey
DKZBBWMURDFHNE-NSCUHMNNSA-N
SMILES
COc1cc(\C=C\C=O)ccc1O
Roles Classification
Biological Role
(s):
antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
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
coniferyl aldehyde (
CHEBI:16547
)
has functional parent
(
E
)-cinnamaldehyde (
CHEBI:16731
)
coniferyl aldehyde (
CHEBI:16547
)
has role
antifungal agent (
CHEBI:35718
)
coniferyl aldehyde (
CHEBI:16547
)
has role
plant metabolite (
CHEBI:76924
)
coniferyl aldehyde (
CHEBI:16547
)
is a
cinnamaldehydes (
CHEBI:23245
)
coniferyl aldehyde (
CHEBI:16547
)
is a
guaiacols (
CHEBI:134251
)
coniferyl aldehyde (
CHEBI:16547
)
is a
phenylpropanoid (
CHEBI:26004
)
Incoming
coniferaldehyde β-
D
-glucoside (
CHEBI:136949
)
has functional parent
coniferyl aldehyde (
CHEBI:16547
)
IUPAC Name
3-(4-hydroxy-3-methoxyphenyl)prop-2-enal
Synonyms
Sources
(
E
)-coniferaldehyde
UniProt
4-Hydroxy-3-methoxycinnamaldehyde
KEGG COMPOUND
4-hydroxy-3-methoxycinnamaldehyde
ChEBI
Coniferaldehyde
KEGG COMPOUND
Coniferyl aldehyde
KEGG COMPOUND
Ferulaldehyde
KEGG COMPOUND
Manual Xrefs
Databases
C00002728
KNApSAcK
C02666
KEGG COMPOUND
CONIFERYL-ALDEHYDE
MetaCyc
Coniferyl_aldehyde
Wikipedia
View more database links
Registry Numbers
Types
Sources
2048208
Reaxys Registry Number
Reaxys
458-36-6
CAS Registry Number
KEGG COMPOUND
458-36-6
CAS Registry Number
ChemIDplus
Citations
Types
Sources
22034160
PubMed citation
Europe PMC
22466741
PubMed citation
Europe PMC
23302528
PubMed citation
Europe PMC
23725839
PubMed citation
Europe PMC
24010325
PubMed citation
Europe PMC
Last Modified
11 October 2019