4-formylbenzoic acid (CHEBI:191179)

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ChEBI Name	4-formylbenzoic acid

ChEBI ID	CHEBI:191179

Definition	A member of the class of benzoic acids that is benzoic acid substituted by a formyl group at position 4.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C8H6O3

Net Charge

Average Mass

150.133

Monoisotopic Mass

150.03169

InChI

InChI=1S/C8H6O3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-5H,(H,10,11)

InChIKey

GOUHYARYYWKXHS-UHFFFAOYSA-N

SMILES

[H]C(=O)C1=CC=C(C=C1)C(O)=O

Metabolite of Species	Details
Hibiscus taiwanensis (NCBI:txid1898877)	Found in stem (BTO:0001300). See: DOI

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	4-formylbenzoic acid (CHEBI:191179) has role plant metabolite (CHEBI:76924) 4-formylbenzoic acid (CHEBI:191179) is a benzaldehydes (CHEBI:22698) 4-formylbenzoic acid (CHEBI:191179) is a benzoic acids (CHEBI:22723) 4-formylbenzoic acid (CHEBI:191179) is a monocarboxylic acid (CHEBI:25384) 4-formylbenzoic acid (CHEBI:191179) is conjugate acid of 4-formylbenzoate (CHEBI:189007)

Incoming	4-formylbenzoate (CHEBI:189007) is conjugate base of 4-formylbenzoic acid (CHEBI:191179)

IUPAC Name

4-formylbenzoic acid

Last Modified

05 June 2023