CHEBI:6825 - Methenamine hippurate

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ChEBI Name Methenamine hippurate
ChEBI ID CHEBI:6825
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C15H21N5O3
C9H9NO3.C6H12N4
Net Charge 0
Average Mass 319.360
Monoisotopic Mass 319.16444
InChI InChI=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
InChIKey ROAIXOJGRFKICW-UHFFFAOYSA-N
SMILES C=1(C(NCC(O)=O)=O)C=CC=CC1.N12CN3CN(C1)CN(C2)C3
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Methenamine hippurate (CHEBI:6825) has functional parent N-benzoylglycine (CHEBI:18089)
Methenamine hippurate (CHEBI:6825) is a N-acylglycine (CHEBI:16180)
Synonym Source
Methenamine hippurate KEGG COMPOUND
Manual Xref Database
D00855 KEGG DRUG
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Registry Number Type Source
5714-73-8 CAS Registry Number KEGG COMPOUND
Last Modified
06 March 2017