5-[(3-hydroxy-4-methoxyphenyl)methyl]oxolan-2-one (CHEBI:193344)

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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	5-[(3-hydroxy-4-methoxyphenyl)methyl]oxolan-2-one

ChEBI ID	CHEBI:193344

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H14O4

Net Charge

Average Mass

222.240

Monoisotopic Mass

222.08921

InChI

InChI=1S/C12H14O4/c1-15-11-4-2-8(7-10(11)13)6-9-3-5-12(14)16-9/h2,4,7,9,13H,3,5-6H2,1H3

InChIKey

CEZQHDADSGTTOP-UHFFFAOYSA-N

SMILES

O1C(CCC1=O)CC2=CC(O)=C(OC)C=C2

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in feces (BTO:0000440). See: MetaboLights Study

ChEBI Ontology
Outgoing	5-[(3-hydroxy-4-methoxyphenyl)methyl]oxolan-2-one (CHEBI:193344) is a methoxybenzenes (CHEBI:51683) 5-[(3-hydroxy-4-methoxyphenyl)methyl]oxolan-2-one (CHEBI:193344) is a phenols (CHEBI:33853)

IUPAC Name

5-[(3-hydroxy-4-methoxyphenyl)methyl]oxolan-2-one