CHEBI:27949 - (E)-sinapaldehyde

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ChEBI Name (E)-sinapaldehyde
ChEBI ID CHEBI:27949
ChEBI ASCII Name (E)-sinapaldehyde
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 208.07356
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.
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ChEBI Ontology
Outgoing (E)-sinapaldehyde (CHEBI:27949) has functional parent (E)-cinnamaldehyde (CHEBI:16731)
(E)-sinapaldehyde (CHEBI:27949) has role antifungal agent (CHEBI:35718)
(E)-sinapaldehyde (CHEBI:27949) has role plant metabolite (CHEBI:76924)
(E)-sinapaldehyde (CHEBI:27949) is a cinnamaldehydes (CHEBI:23245)
(E)-sinapaldehyde (CHEBI:27949) is a dimethoxybenzene (CHEBI:51681)
(E)-sinapaldehyde (CHEBI:27949) is a phenols (CHEBI:33853)
Incoming (E)-nesocodin (alcohol-form) zwitterion (CHEBI:191394) has functional parent (E)-sinapaldehyde (CHEBI:27949)
(E)-nesocodin (oxo-form) zwitterion (CHEBI:191393) has functional parent (E)-sinapaldehyde (CHEBI:27949)
(E)-sinapaldehyde 4-O-β-D-glucopyranoside (CHEBI:142126) has functional parent (E)-sinapaldehyde (CHEBI:27949)
4-acetoxy-3,5-dimethoxy-trans-cinnamaldehyde (CHEBI:86587) has functional parent (E)-sinapaldehyde (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)-sinapaldehyde UniProt
(E)-sinapoyl aldehyde ChEBI
Sinapaldehyde KEGG COMPOUND
Sinapoyl aldehyde KEGG COMPOUND
sinapyl aldehyde ChemIDplus
Manual Xrefs Databases
C00002775 KNApSAcK
C05610 KEGG COMPOUND
Sinapaldehyde Wikipedia
SINAPALDEHYDE MetaCyc
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Registry Numbers Types Sources
2215799 Beilstein Registry Number Beilstein
2215799 Reaxys Registry Number Reaxys
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
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Last Modified
09 May 2022