Chamanetin (CHEBI:186240)

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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	Chamanetin

ChEBI ID	CHEBI:186240

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C22H18O5

Net Charge

Average Mass

362.381

Monoisotopic Mass

362.11542

InChI

InChI=1S/C22H18O5/c23-16-9-5-4-8-14(16)10-15-17(24)11-18(25)21-19(26)12-20(27-22(15)21)13-6-2-1-3-7-13/h1-9,11,20,23-25H,10,12H2

InChIKey

SDGMASFMCKFHSI-UHFFFAOYSA-N

SMILES

O1C(CC(=O)C=2C1=C(CC=3C(O)=CC=CC3)C(O)=CC2O)C4=CC=CC=C4

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

Roles Classification
Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. (via diarylheptanoid )

ChEBI Ontology
Outgoing	Chamanetin (CHEBI:186240) is a diarylheptanoid (CHEBI:78802)

IUPAC Name

5,7-dihydroxy-8-[(2-hydroxyphenyl)methyl]-2-phenyl-2,3-dihydrochromen-4-one