EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:64703 - p-aminohippurate

ChEBI IDCHEBI:64703
ChEBI Namep-aminohippurate
Stars
ASCII Namep-aminohippurate
DefinitionA hippurate that is the conjugate base of p-aminohippuric acid, arising from deprotonation of the carboxy group.
Last Modified27 May 2022
SubmitterSteve
DownloadsMolfile
FormulaC9H9N2O3
Net Charge-1
Average Mass193.182
Monoisotopic Mass193.06187
SMILESNc1ccc(C(=O)NCC(=O)[O-])cc1
InChIInChI=1S/C9H10N2O3/c10-7-3-1-6(2-4-7)9(14)11-5-8(12)13/h1-4H,5,10H2,(H,11,14)(H,12,13)/p-1
InChIKeyHSMNQINEKMPTIC-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
p-aminohippurate (CHEBI:64703) is a hippurates (CHEBI:132966)
p-aminohippurate (CHEBI:64703) is conjugate base of p-aminohippuric acid (CHEBI:104011)
Incoming Relation(s)
sodium p-aminohippurate (CHEBI:31204) has part p-aminohippurate (CHEBI:64703)
p-aminohippuric acid (CHEBI:104011) is conjugate acid of p-aminohippurate (CHEBI:64703)
IUPAC Name 
[(4-aminobenzoyl)amino]acetate
Synonyms  Source
4-aminohippurate(1−)ChEBI
AminohippurateHMDB
para-AminohippurateHMDB
4-aminohippurateChEBI
N-(p-Aminobenzoyl)aminoacetateHMDB
UniProt Name  Source
4-aminohippurateUniProt
Manual XrefsDatabases
HMDB0001867HMDB
Registry NumbersSources
Reaxys:5953141Reaxys
Citations