Emoroidenone (CHEBI:180257)

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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	Emoroidenone

ChEBI ID	CHEBI:180257

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H20O4

Net Charge

Average Mass

336.387

Monoisotopic Mass

336.13616

InChI

InChI=1S/C21H20O4/c1-12(2)16-9-14-18(24-16)11-19(23-3)20-15(22)10-17(25-21(14)20)13-7-5-4-6-8-13/h4-8,11,16-17H,1,9-10H2,2-3H3

InChIKey

ILWIXDUFMCFWAS-UHFFFAOYSA-N

SMILES

O1C(CC2=C3OC(CC(=O)C3=C(OC)C=C12)C4=CC=CC=C4)C(C)=C

ChEBI Ontology
Outgoing	Emoroidenone (CHEBI:180257) is a flavanones (CHEBI:28863)

IUPAC Name

5-methoxy-2-phenyl-8-prop-1-en-2-yl-2,3,8,9-tetrahydrouro[2,3-h]chromen-4-one