CHEBI:193161 - isovanillin

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ChEBI Name isovanillin
ChEBI ID CHEBI:193161
Definition A member of the class of benzaldehydes that is 4-methoxybenzaldehyde substituted by a hydroxy group at position 3. It is an inhibitor of aldehyde oxidase.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C8H8O3
Net Charge 0
Average Mass 152.149
Monoisotopic Mass 152.04734
InChI InChI=1S/C8H8O3/c1-11-8-3-2-6(5-9)4-7(8)10/h2-5,10H,1H3
InChIKey JVTZFYYHCGSXJV-UHFFFAOYSA-N
SMILES [H]C(=O)C1=CC=C(OC)C(O)=C1
Metabolite of Species Details
Jatropha curcas (NCBI:txid180498) Found in stem (BTO:0001300). See: PubMed
Mondia whitei (NCBI:txid244352) Found in Root (BTO:0001188). See: DOI
Pycnocycla sp.nosa (NCBI:txid325745) See: PubMed
Pycnocycla sp.nosa (NCBI:txid325745) See: PubMed
Tachigali paniculata (NCBI:txid53928) Found in leaf (BTO:0000713). See: PubMed
Lonicera fulvotomentosa (NCBI:txid643838) Found in flower bud (BTO:0000470). See: PubMed
Apis mellifera (NCBI:txid7460) Found in propolis. See: PubMed
Arum palaestinum (NCBI:txid749969) See: PubMed
Roles Classification
Biological Role(s): EC 1.2.3.1 (aldehyde oxidase) inhibitor
An EC 1.2.3.* (oxidoreductase acting on donor aldehyde/oxo group with oxygen as acceptor) inhibitor which interferes with the action of aldehyde oxidase (EC 1.2.3.1).
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
HIV protease inhibitor
An inhibitor of HIV protease, an enzyme required for production of proteins needed for viral assembly.
animal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
Application(s): antidiarrhoeal drug
Any drug found useful in the symptomatic treatment of diarrhoea.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing isovanillin (CHEBI:193161) has role animal metabolite (CHEBI:75767)
isovanillin (CHEBI:193161) has role antidiarrhoeal drug (CHEBI:55323)
isovanillin (CHEBI:193161) has role antifungal agent (CHEBI:35718)
isovanillin (CHEBI:193161) has role EC 1.2.3.1 (aldehyde oxidase) inhibitor (CHEBI:62872)
isovanillin (CHEBI:193161) has role HIV protease inhibitor (CHEBI:35660)
isovanillin (CHEBI:193161) has role plant metabolite (CHEBI:76924)
isovanillin (CHEBI:193161) is a benzaldehydes (CHEBI:22698)
isovanillin (CHEBI:193161) is a monomethoxybenzene (CHEBI:25235)
isovanillin (CHEBI:193161) is a phenols (CHEBI:33853)
IUPAC Name
3-hydroxy-4-methoxybenzaldehyde
Synonyms Sources
3-hydroxy-p-anisaldehyde ChemIDplus
3-hydroxy-para-anisaldehyde NIST Chemistry WebBook
5-formyl-2-methoxyphenol ChEBI
5-formylguaiacol ChemIDplus
iso-vanillin ChEBI
isovanilline ChemIDplus
m-hydroxy-p-methoxybenzaldehyde ChEBI
Manual Xrefs Databases
C00044826 KNApSAcK
CPD-8489 MetaCyc
EP0758639 Patent
Isovanillin Wikipedia
View more database links
Registry Numbers Types Sources
1073021 Reaxys Registry Number Reaxys
621-59-0 CAS Registry Number ChemIDplus
621-59-0 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
1154798 PubMed citation Europe PMC
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IND22435184 Agricola citation Europe PMC
Last Modified
29 September 2022