6-methyl-3-(4-methoxyphenyl)-4-phenylcoumarin (CHEBI:191047)

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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	6-methyl-3-(4-methoxyphenyl)-4-phenylcoumarin

ChEBI ID	CHEBI:191047

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C23H18O3

Net Charge

Average Mass

342.394

Monoisotopic Mass

342.12559

InChI

InChI=1S/C23H18O3/c1-15-8-13-20-19(14-15)21(16-6-4-3-5-7-16)22(23(24)26-20)17-9-11-18(25-2)12-10-17/h3-14H,1-2H3

InChIKey

HGDQXMRHMLHGOR-UHFFFAOYSA-N

SMILES

O1C2=C(C(=C(C3=CC=C(OC)C=C3)C1=O)C4=CC=CC=C4)C=C(C=C2)C

Metabolite of Species	Details
Rattus norvegicus (NCBI:txid10116)	Found in INS-1 cell (BTO:0002135). See: MetaboLights Study

ChEBI Ontology
Outgoing	6-methyl-3-(4-methoxyphenyl)-4-phenylcoumarin (CHEBI:191047) is a neoflavonoid (CHEBI:71971)

IUPAC Name

3-(4-methoxyphenyl)-6-methyl-4-phenylchromen-2-one