CHEBI:27949 - sinapoyl aldehyde

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ChEBI Name sinapoyl aldehyde
ChEBI ID CHEBI:27949
Definition A member of the class of cinnamaldehydes that is cinnamaldehyde substituted by a hydroxy group at position 4 and methoxy groups at positions 3 and 5.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:9153, CHEBI:26684
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Formula C11H12O4
Net Charge 0
Average Mass 208.21058
Monoisotopic Mass 208.074
InChI InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+
InChIKey CDICDSOGTRCHMG-ONEGZZNKSA-N
SMILES [H]C(=O)\C=C\c1cc(OC)c(O)c(OC)c1
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 sinapoyl aldehyde (CHEBI:27949) has functional parent cinnamaldehyde (CHEBI:16731)
sinapoyl aldehyde (CHEBI:27949) has role antifungal agent (CHEBI:35718)
sinapoyl aldehyde (CHEBI:27949) has role plant metabolite (CHEBI:76924)
sinapoyl aldehyde (CHEBI:27949) is a cinnamaldehydes (CHEBI:23245)
sinapoyl aldehyde (CHEBI:27949) is a dimethoxybenzene (CHEBI:51681)
sinapoyl aldehyde (CHEBI:27949) is a phenols (CHEBI:33853)
Incoming 4-acetoxy-3,5-dimethoxy-trans-cinnamaldehyde (CHEBI:86587) has functional parent sinapoyl aldehyde (CHEBI:27949)
IUPAC Name
(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enal
Synonyms Sources
(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylaldehyde ChEBI
(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenal ChemIDplus
(E)-sinapoyl aldehyde UniProt
Sinapaldehyde KEGG COMPOUND
Sinapoyl aldehyde KEGG COMPOUND
sinapyl aldehyde ChemIDplus
Database Links Databases
C00002775 KNApSAcK
C05610 KEGG COMPOUND
Sinapaldehyde Wikipedia
SINAPALDEHYDE MetaCyc
View more database links
Registry Numbers Types Sources
2215799 Reaxys Registry Number Reaxys
2215799 Beilstein Registry Number Beilstein
4206-58-0 CAS Registry Number KEGG COMPOUND
4206-58-0 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
21080014 PubMed citation Europe PMC
22034160 PubMed citation Europe PMC
22466741 PubMed citation Europe PMC
23561163 PubMed citation Europe PMC
Last Modified
23 July 2015