CHEBI:58203 - 2-formylbenzoate

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ChEBI Name 2-formylbenzoate
ChEBI ID CHEBI:58203
Definition A benzoate anion arising from deprotonation of the carboxy group of 2-formylbenzoic acid; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C8H5O3
Net Charge -1
Average Mass 149.12350
Monoisotopic Mass 149.02442
InChI InChI=1S/C8H6O3/c9-5-6-3-1-2-4-7(6)8(10)11/h1-5H,(H,10,11)/p-1
InChIKey DYNFCHNNOHNJFG-UHFFFAOYSA-M
SMILES [O-]C(=O)c1ccccc1C=O
Roles Classification
Biological Role(s): bacterial xenobiotic metabolite
Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
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ChEBI Ontology
Outgoing 2-formylbenzoate (CHEBI:58203) has role bacterial xenobiotic metabolite (CHEBI:76976)
2-formylbenzoate (CHEBI:58203) has role mouse metabolite (CHEBI:75771)
2-formylbenzoate (CHEBI:58203) is a aldehydic acid anion (CHEBI:71944)
2-formylbenzoate (CHEBI:58203) is a benzoates (CHEBI:22718)
2-formylbenzoate (CHEBI:58203) is conjugate base of 2-formylbenzoic acid (CHEBI:17605)
Incoming 2-formylbenzoic acid (CHEBI:17605) is conjugate acid of 2-formylbenzoate (CHEBI:58203)
IUPAC Name
2-formylbenzoate
Synonyms Sources
2-carboxylatobenzaldehyde ChEBI
2-formylbenzoate UniProt
2-formylbenzoate anion ChEBI
2-formylbenzoate(1−) ChEBI
Registry Number Type Source
3664008 Reaxys Registry Number Reaxys
Last Modified
19 June 2014