Suberenone (CHEBI:174256)

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ChEBI Ontology

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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	Suberenone

ChEBI ID	CHEBI:174256

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H12O4

Net Charge

Average Mass

244.246

Monoisotopic Mass

244.07356

InChI

InChI=1S/C14H12O4/c1-9(15)3-4-10-7-11-5-6-14(16)18-13(11)8-12(10)17-2/h3-8H,1-2H3/b4-3+

InChIKey

GSVYFPMXLIFUDJ-ONEGZZNKSA-N

SMILES

O1C=2C(=CC(=C(OC)C2)/C=C/C(=O)C)C=CC1=O

ChEBI Ontology
Outgoing	Suberenone (CHEBI:174256) is a coumarins (CHEBI:23403)

IUPAC Name

7-methoxy-6-[(E)-3-oxobut-1-enyl]chromen-2-one