Graphenone (CHEBI:215603)

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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	Graphenone

ChEBI ID	CHEBI:215603

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H14O4

Net Charge

Average Mass

246.262

Monoisotopic Mass

246.08921

InChI

InChI=1S/C14H14O4/c1-9(11(3)15)7-5-4-6-8-12-10(2)13(16)18-14(12)17/h4-8H,1-3H3/b5-4+,8-6+,9-7-

InChIKey

DPZNQXPHRMGJIG-OEBYFBIZSA-N

SMILES

O=C1OC(=O)C(=C1/C=C/C=C/C=C(\C(=O)C)/C)C

ChEBI Ontology
Outgoing	Graphenone (CHEBI:215603) is a butenolide (CHEBI:50523)

IUPAC Name

3-methyl-4-[(1E,3E,5Z)-6-methyl-7-oxoocta-1,3,5-trienyl]uran-2,5-dione