Irisolone methyl ether (CHEBI:196330)

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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	Irisolone methyl ether

ChEBI ID	CHEBI:196330

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H14O6

Net Charge

Average Mass

326.304

Monoisotopic Mass

326.07904

InChI

InChI=1S/C18H14O6/c1-20-11-5-3-10(4-6-11)12-8-22-13-7-14-17(24-9-23-14)18(21-2)15(13)16(12)19/h3-8H,9H2,1-2H3

InChIKey

LCIXCHCKTZRXMH-UHFFFAOYSA-N

SMILES

O1C=2C(=C(OC)C=3OCOC3C2)C(=O)C(C4=CC=C(OC)C=C4)=C1

ChEBI Ontology
Outgoing	Irisolone methyl ether (CHEBI:196330) is a methoxyisoflavone (CHEBI:38756)

IUPAC Name

9-methoxy-7-(4-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one