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CHEBI:190738 - Demethylated antipyrine

ChEBI IDCHEBI:190738
ChEBI NameDemethylated antipyrine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H10N2O
Net Charge0
Average Mass174.203
Monoisotopic Mass174.07931
SMILESCc1cc(=O)n(-c2ccccc2)n1
InChIInChI=1S/C10H10N2O/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h2-7,11H,1H3
InChIKeyKZQYIMCESJLPQH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oreochromis niloticus (ncbitaxon:8128) serum (BTO:0001239) MetaboLights (MTBLS4262)
ChEBI Ontology
Outgoing Relation(s)
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 XrefsDatabases
63516ChemSpider
C13008KEGG COMPOUND
HMDB0006240HMDB
Registry NumbersSources
CAS:19735-89-8ChemIDplus