2-(1,3-Benzodioxol-5-yl)-7-hydroxy-3,5,6,8-tetramethoxy-4H-1-benzopyran-4-one (CHEBI:188232)

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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	2-(1,3-Benzodioxol-5-yl)-7-hydroxy-3,5,6,8-tetramethoxy-4H-1-benzopyran-4-one

ChEBI ID	CHEBI:188232

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H18O9

Net Charge

Average Mass

402.355

Monoisotopic Mass

402.09508

InChI

InChI=1S/C20H18O9/c1-23-16-12-13(21)18(24-2)15(9-5-6-10-11(7-9)28-8-27-10)29-17(12)20(26-4)14(22)19(16)25-3/h5-7,22H,8H2,1-4H3

InChIKey

MRWINNLHVMLDLR-UHFFFAOYSA-N

SMILES

O1C2=C(C(OC)=C(OC)C(O)=C2OC)C(=O)C(OC)=C1C3=CC=4OCOC4C=C3

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO:0000131). See: MetaboLights Study

ChEBI Ontology
Outgoing	2-(1,3-Benzodioxol-5-yl)-7-hydroxy-3,5,6,8-tetramethoxy-4H-1-benzopyran-4-one (CHEBI:188232) is a ether (CHEBI:25698) 2-(1,3-Benzodioxol-5-yl)-7-hydroxy-3,5,6,8-tetramethoxy-4H-1-benzopyran-4-one (CHEBI:188232) is a flavonoids (CHEBI:72544)

IUPAC Name

2-(1,3-benzodioxol-5-yl)-7-hydroxy-3,5,6,8-tetramethoxychromen-4-one