2,5-dimethoxy-5'-fluoro-2'-hydroxychalcone (CHEBI:190970)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	2,5-dimethoxy-5'-fluoro-2'-hydroxychalcone

ChEBI ID	CHEBI:190970

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H15FO4

Net Charge

Average Mass

302.301

Monoisotopic Mass

302.09544

InChI

InChI=1S/C17H15FO4/c1-21-13-5-8-17(22-2)11(9-13)3-6-15(19)14-10-12(18)4-7-16(14)20/h3-10,20H,1-2H3/b6-3+

InChIKey

VLHXJPAPLGACMR-ZZXKWVIFSA-N

SMILES

FC1=CC(C(=O)\C=C\C2=C(OC)C=CC(OC)=C2)=C(O)C=C1

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

ChEBI Ontology
Outgoing	2,5-dimethoxy-5'-fluoro-2'-hydroxychalcone (CHEBI:190970) is a chalcones (CHEBI:23086)

IUPAC Name

(E)-3-(2,5-dimethoxyphenyl)-1-(5-luoro-2-hydroxyphenyl)prop-2-en-1-one