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CHEBI:6825 - Methenamine hippurate

ChEBI IDCHEBI:6825
ChEBI NameMethenamine hippurate
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC6H12N4.C9H9NO3
Net Charge0
Average Mass319.365
Monoisotopic Mass319.16444
SMILESC1N2CN3CN1CN(C2)C3.O=C(O)CNC(=O)c1ccccc1
InChIInChI=1S/C9H9NO3.C6H12N4/c11-8(12)6-10-9(13)7-4-2-1-3-5-7;1-7-2-9-4-8(1)5-10(3-7)6-9/h1-5H,6H2,(H,10,13)(H,11,12);1-6H2
InChIKeyROAIXOJGRFKICW-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Methenamine hippurate (CHEBI:6825) has functional parent N-benzoylglycine (CHEBI:18089)
Methenamine hippurate (CHEBI:6825) is a N-acylglycine (CHEBI:16180)
Synonym  Source
Methenamine hippurateKEGG COMPOUND
Manual XrefsDatabases
D00855KEGG DRUG
Registry NumbersSources
CAS:5714-73-8KEGG COMPOUND