CHEBI:83526 - 4-formylaminoantipyrine

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ChEBI Name 4-formylaminoantipyrine
ChEBI ID CHEBI:83526
Definition A pyrazolone that is 1,2-dihydro-3H-pyrazol-3-one substituted by a formaylamino group at position 4, methyl groups at positions 1 and 5 and a phenyl group at position 2. It is a metabolite of aminophenazone.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information eMolecules:535574, ZINC000001570229
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Formula C12H13N3O2
Net Charge 0
Average Mass 231.25050
Monoisotopic Mass 231.10078
InChI InChI=1S/C12H13N3O2/c1-9-11(13-8-16)12(17)15(14(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,16)
InChIKey WSJBSKRPKADYRQ-UHFFFAOYSA-N
SMILES Cc1c(NC=O)c(=O)n(-c2ccccc2)n1C
Roles Classification
Biological Role(s): drug metabolite

marine xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 4-formylaminoantipyrine (CHEBI:83526) has role drug metabolite (CHEBI:49103)
4-formylaminoantipyrine (CHEBI:83526) has role marine xenobiotic metabolite (CHEBI:83399)
4-formylaminoantipyrine (CHEBI:83526) is a formamides (CHEBI:24079)
4-formylaminoantipyrine (CHEBI:83526) is a pyrazolone (CHEBI:83328)
IUPAC Name
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)formamide
Synonym Source
N-antipyrinyl formamide ChemIDplus
Registry Numbers Types Sources
1672-58-8 CAS Registry Number ChemIDplus
217665 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
1182870 PubMed citation Europe PMC
1182905 PubMed citation Europe PMC
975420 PubMed citation Europe PMC
Last Modified
18 November 2014