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CHEBI:83716 - 2-aminophenylglyoxylic acid

ChEBI IDCHEBI:83716
ChEBI Name2-aminophenylglyoxylic acid
Stars
DefinitionA 2-oxo monocarboxylic acid that is glyoxylic acid in which the aldehydic hydrogen is replaced by a 2-aminophenyl group.
Last Modified13 November 2014
SubmitterSteve
DownloadsMolfile
FormulaC8H7NO3
Net Charge0
Average Mass165.148
Monoisotopic Mass165.04259
SMILESNc1ccccc1C(=O)C(=O)O
InChIInChI=1S/C8H7NO3/c9-6-4-2-1-3-5(6)7(10)8(11)12/h1-4H,9H2,(H,11,12)
InChIKeyMQMWPBBDMIYYMI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bradyrhizobium japonicum (ncbitaxon:375) - PubMed (7592320)
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
2-aminophenylglyoxylic acid (CHEBI:83716) has functional parent glyoxylic acid (CHEBI:16891)
2-aminophenylglyoxylic acid (CHEBI:83716) has role bacterial xenobiotic metabolite (CHEBI:76976)
2-aminophenylglyoxylic acid (CHEBI:83716) is a 2-oxo monocarboxylic acid (CHEBI:35910)
2-aminophenylglyoxylic acid (CHEBI:83716) is a substituted aniline (CHEBI:48975)
2-aminophenylglyoxylic acid (CHEBI:83716) is conjugate acid of 2-aminophenylglyoxylate (CHEBI:82904)
Incoming Relation(s)
2-aminophenylglyoxylate (CHEBI:82904) is conjugate base of 2-aminophenylglyoxylic acid (CHEBI:83716)
IUPAC Name 
(2-aminophenyl)(oxo)acetic acid
Synonyms  Source
o-aminophenylglyoxylic acidChEBI
isatinic acidChEBI
Registry NumbersSources
Reaxys:2691287Reaxys
Citations