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CHEBI:104011 - p-aminohippuric acid

ChEBI IDCHEBI:104011
ChEBI Namep-aminohippuric acid
Stars
ASCII Namep-aminohippuric acid
DefinitionAn N-acylglycine that is the 4-amino derivative of hippuric acid; used as a diagnostic agent in the measurement of renal plasma flow.
Secondary ChEBI IDCHEBI:59134
Last Modified22 February 2017
SubmitterBijay
DownloadsMolfile
FormulaC9H10N2O3
Net Charge0
Average Mass194.190
Monoisotopic Mass194.06914
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)
InChIKeyHSMNQINEKMPTIC-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Daphnia magna (ncbitaxon:35525) - Article (Mixtures of similarly acting compounds in Daphnia magna: From gene to metabolite and beyondTine Vandenbrouck, Oliver A.H. Jones, Nathalie Dom, Julian L. Griffin, Wim De CoenEnvironment International 36 (2010) 254-268)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
Daphnia magna metabolite  A Daphnia metabolite produced by the species Daphnia magna.
ChEBI Ontology
Outgoing Relation(s)
p-aminohippuric acid (CHEBI:104011) has role Daphnia magna metabolite (CHEBI:83056)
p-aminohippuric acid (CHEBI:104011) is a N-acylglycine (CHEBI:16180)
p-aminohippuric acid (CHEBI:104011) is conjugate acid of p-aminohippurate (CHEBI:64703)
Incoming Relation(s)
p-aminohippurate (CHEBI:64703) is conjugate base of p-aminohippuric acid (CHEBI:104011)
IUPAC Name 
N-(4-aminobenzoyl)glycine
Synonyms  Source
Aminohippuric acidKEGG DRUG
N-(p-Aminobenzoyl)aminoacetic acidChemIDplus
N-(p-Aminobenzoyl)glycineChemIDplus
N-(para-aminobenzoyl)glycineChemIDplus
para-Aminohippuric acidChemIDplus
4-aminohippuric acidSUBMITTER
Manual XrefsDatabases
D06890KEGG DRUG
DB00345DrugBank
Aminohippuric_AcidWikipedia
HMDB0001867HMDB
LSM-5739LINCS
165DrugCentral
Registry NumbersSources
Beilstein:1216376Beilstein
Gmelin:848144Gmelin
Reaxys:1213676Reaxys
CAS:61-78-9KEGG DRUG
CAS:61-78-9ChemIDplus
Citations