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CHEBI:70824 - m-hydroxyhippuric acid

ChEBI IDCHEBI:70824
ChEBI Namem-hydroxyhippuric acid
Stars
ASCII Namem-hydroxyhippuric acid
DefinitionAn N-acylglycine that is hippuric acid (N-benzoylglycine) substituted at position 3 on the phenyl ring by a hydroxy group.
Last Modified4 October 2016
Submittermwilliams
DownloadsMolfile
FormulaC9H9NO4
Net Charge0
Average Mass195.174
Monoisotopic Mass195.05316
SMILESO=C(O)CNC(=O)c1cccc(O)c1
InChIInChI=1S/C9H9NO4/c11-7-3-1-2-6(4-7)9(14)10-5-8(12)13/h1-4,11H,5H2,(H,10,14)(H,12,13)
InChIKeyXDOFWFNMYJRHEW-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
m-hydroxyhippuric acid (CHEBI:70824) has functional parent N-benzoylglycine (CHEBI:18089)
m-hydroxyhippuric acid (CHEBI:70824) has role metabolite (CHEBI:25212)
m-hydroxyhippuric acid (CHEBI:70824) is a N-acylglycine (CHEBI:16180)
m-hydroxyhippuric acid (CHEBI:70824) is a phenols (CHEBI:33853)
m-hydroxyhippuric acid (CHEBI:70824) is conjugate acid of m-hydroxyhippurate (CHEBI:133607)
Incoming Relation(s)
m-hydroxyhippurate (CHEBI:133607) is conjugate base of m-hydroxyhippuric acid (CHEBI:70824)
IUPAC Names 
[(3-hydroxybenzoyl)amino]acetic acid
N-(3-hydroxybenzoyl)glycine
Synonyms  Source
3-hydroxyhippuric acidHMDB
2-[(3-hydroxyphenyl)formamido]acetic acidDrugBank
3-hydroxybenzoylglycineHMDB
Manual XrefsDatabases
HMDB0006116HMDB
3XHPDBeChem
DB07069DrugBank
Registry NumbersSources
Reaxys:2110259Reaxys
CAS:1637-75-8ChemIDplus
Citations