CHEBI:190738 - Demethylated antipyrine

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Demethylated antipyrine
ChEBI ID CHEBI:190738
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H10N2O
Net Charge 0
Average Mass 174.203
Monoisotopic Mass 174.07931
InChI InChI=1S/C10H10N2O/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h2-7,11H,1H3
InChIKey KZQYIMCESJLPQH-UHFFFAOYSA-N
SMILES O=C1N(NC(=C1)C)C2=CC=CC=C2
Metabolite of Species Details
Oreochromis niloticus (NCBI:txid8128) Found in serum (BTO:0001239). See: MetaboLights Study
ChEBI Ontology
Outgoing Demethylated antipyrine (CHEBI:190738) is a pyrazoles (CHEBI:26410)
Demethylated antipyrine (CHEBI:190738) is a ring assembly (CHEBI:36820)
IUPAC Name
5-methyl-2-phenyl-1H-pyrazol-3-one
Manual Xrefs Databases
63516 ChemSpider
C13008 KEGG COMPOUND
HMDB0006240 HMDB
View more database links
Registry Number Type Source
19735-89-8 CAS Registry Number ChemIDplus