Carpachromene dimethyl ether (CHEBI:187698)

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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	Carpachromene dimethyl ether

ChEBI ID	CHEBI:187698

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C22H20O5

Net Charge

Average Mass

364.397

Monoisotopic Mass

364.13107

InChI

InChI=1S/C22H20O5/c1-22(2)10-9-15-18(27-22)12-19-20(21(15)25-4)16(23)11-17(26-19)13-5-7-14(24-3)8-6-13/h5-12H,1-4H3

InChIKey

SLFBWUSMSGUNQP-UHFFFAOYSA-N

SMILES

O1C(C=CC2=C1C=C3OC(=CC(=O)C3=C2OC)C4=CC=C(OC)C=C4)(C)C

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

ChEBI Ontology
Outgoing	Carpachromene dimethyl ether (CHEBI:187698) is a extended flavonoid (CHEBI:71037)

IUPAC Name

5-methoxy-8-(4-methoxyphenyl)-2,2-dimethylpyrano[3,2-g]chromen-6-one