4,6-dimethyl-2,7-diphenyl-3,7-dihydro-2H-pyrazolo[3,4-b]pyridin-3-one (CHEBI:183352)

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ChEBI Name	4,6-dimethyl-2,7-diphenyl-3,7-dihydro-2H-pyrazolo[3,4-b]pyridin-3-one

ChEBI ID	CHEBI:183352

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H17N3O

Net Charge

Average Mass

315.376

Monoisotopic Mass

315.13716

InChI

InChI=1S/C20H17N3O/c1-14-13-15(2)22(16-9-5-3-6-10-16)19-18(14)20(24)23(21-19)17-11-7-4-8-12-17/h3-13H,1-2H3

InChIKey

LUIUYGXMWCAILW-UHFFFAOYSA-N

SMILES

O=C1N(N=C2N(C(=CC(=C21)C)C)C3=CC=CC=C3)C4=CC=CC=C4

Metabolite of Species	Details
Bombus terrestris (NCBI:txid30195)	Found in brain (BTO:0000142). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195)	Found in hindgut (BTO:0000510). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195)	Found in hemolymph (BTO:0000572). See: MetaboLights Study

ChEBI Ontology
Outgoing	4,6-dimethyl-2,7-diphenyl-3,7-dihydro-2H-pyrazolo[3,4-b]pyridin-3-one (CHEBI:183352) is a pyrazoles (CHEBI:26410) 4,6-dimethyl-2,7-diphenyl-3,7-dihydro-2H-pyrazolo[3,4-b]pyridin-3-one (CHEBI:183352) is a ring assembly (CHEBI:36820)

IUPAC Name

4,6-dimethyl-2,7-diphenylpyrazolo[3,4-b]pyridin-3-one