CHEBI:64682 - metronidazole(1+)

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ChEBI Name metronidazole(1+) ChEBI ID CHEBI:64682 Definition An organic cation resulting from the addition of a proton to metronidazole. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C6H10N3O3 Net Charge +1 Average Mass 172.16190 Monoisotopic Mass 172.07167 InChI InChI=1S/C6H9N3O3/c1-5-7-4-6(9(11)12)8(5)2-3-10/h4,10H,2-3H2,1H3/p+1 InChIKey VAOCPAMSLUNLGC-UHFFFAOYSA-O SMILES [H+].Cc1ncc(n1CCO)[N+]([O-])=O ChEBI Ontology Outgoing metronidazole(1+) (CHEBI:64682) is a organic cation (CHEBI:25697) metronidazole(1+) (CHEBI:64682) is conjugate acid of metronidazole (CHEBI:6909) Incoming metronidazole hydrochloride (CHEBI:50687) has part metronidazole(1+) (CHEBI:64682) metronidazole (CHEBI:6909) is conjugate base of metronidazole(1+) (CHEBI:64682) Last Modified 25 May 2012