CHEBI:228492 - 2-{[2-(3-cyano-2-pyridinyl)hydrazino]carbonyl}benzoic acid

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ChEBI Name 2-{[2-(3-cyano-2-pyridinyl)hydrazino]carbonyl}benzoic acid
ChEBI ID CHEBI:228492
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H10N4O3
Net Charge 0
Average Mass 282.259
Monoisotopic Mass 282.07529
InChI InChI=1S/C14H10N4O3/c15-8-9-4-3-7-16-12(9)17-18-13(19)10-5-1-2-6-11(10)14(20)21/h1-7H,(H,16,17)(H,18,19)(H,20,21)
InChIKey UQQPNJMBAFXSLH-UHFFFAOYSA-N
SMILES O=C(NNC=1N=CC=CC1C#N)C=2C(=CC=CC2)C(O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-{[2-(3-cyano-2-pyridinyl)hydrazino]carbonyl}benzoic acid (CHEBI:228492) is a benzoic acids (CHEBI:22723)
IUPAC Name
2-[[(3-cyanopyridin-2-yl)amino]carbamoyl]benzoic acid
Manual Xref Database
2090491 ChemSpider
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