(+)-echinoisoflavanone (CHEBI:229874)

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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	(+)-echinoisoflavanone

ChEBI ID	CHEBI:229874

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C22H24O7

Net Charge

Average Mass

400.427

Monoisotopic Mass

400.15220

InChI

InChI=1S/C22H24O7/c1-12(2)5-6-14-17(27-3)8-7-15(20(14)28-4)22(26)11-29-18-10-13(23)9-16(24)19(18)21(22)25/h5,7-10,23-24,26H,6,11H2,1-4H3

InChIKey

BNNYBQXTFXFCME-UHFFFAOYSA-N

SMILES

O1CC(O)(C2=C(OC)C(=C(OC)C=C2)CC=C(C)C)C(=O)C=3C1=CC(O)=CC3O

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

ChEBI Ontology
Outgoing	(+)-echinoisoflavanone (CHEBI:229874) is a isoflavanones (CHEBI:38741)

IUPAC Name

3-[2,4-dimethoxy-3-(3-methylbut-2-enyl)phenyl]-3,5,7-trihydroxy-2H-chromen-4-one