Baeckeol (CHEBI:229065)

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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	Baeckeol

ChEBI ID	CHEBI:229065

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H18O4

Net Charge

Average Mass

238.283

Monoisotopic Mass

238.12051

InChI

InChI=1S/C13H18O4/c1-7(2)12(14)11-10(17-5)6-9(16-4)8(3)13(11)15/h6-7,15H,1-5H3

InChIKey

FEPANGQIGHBDFZ-UHFFFAOYSA-N

SMILES

O(C1=C(C(=O)C(C)C)C(O)=C(C(OC)=C1)C)C

Metabolite of Species	Details
Zea mays (NCBI:txid4577)	Found in exometabolome See: MetaboLights Study

ChEBI Ontology
Outgoing	Baeckeol (CHEBI:229065) is a aromatic ketone (CHEBI:76224)

IUPAC Name

1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)-2-methylpropan-1-one