semilicoisoflavone B (CHEBI:69093)

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ChEBI Name	semilicoisoflavone B

ChEBI ID	CHEBI:69093

Definition	A member of the class of 7-hydroxyisoflavones that is 2',2'-dimethyl-2'H,4H-3,6'-bichromen-4-one substituted by hydroxy groups at positions 5, 7 and 8'. It has been isolated from Glycyrrhiza uralensis.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C20H16O6

Net Charge

Average Mass

352.33740

Monoisotopic Mass

352.09469

InChI

InChI=1S/C20H16O6/c1-20(2)4-3-10-5-11(6-15(23)19(10)26-20)13-9-25-16-8-12(21)7-14(22)17(16)18(13)24/h3-9,21-23H,1-2H3

InChIKey

LWZACZCRAUQSLH-UHFFFAOYSA-N

SMILES

CC1(C)Oc2c(O)cc(cc2C=C1)-c1coc2cc(O)cc(O)c2c1=O

Metabolite of Species	Details
Glycyrrhiza uralensis (NCBI:txid74613)	Found in root (BTO:0001188). Dried and ground roots extracted with supercritical CO2 with 5% EtOH as modifier See: PubMed

Roles Classification
Biological Role(s):	EC 1.1.1.21 (aldehyde reductase) inhibitor An EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD+ or NADP+ acceptor) inhibitor that interferes with the action of aldehyde reductase (EC 1.1.1.21). plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	semilicoisoflavone B (CHEBI:69093) has role EC 1.1.1.21 (aldehyde reductase) inhibitor (CHEBI:48550) semilicoisoflavone B (CHEBI:69093) has role plant metabolite (CHEBI:76924) semilicoisoflavone B (CHEBI:69093) is a 7-hydroxyisoflavones (CHEBI:55465)

IUPAC Name

5,7,8'-trihydroxy-2',2'-dimethyl-2'H,4H-3,6'-bichromen-4-one

Synonyms	Sources
5,7,8'-trihydroxy-2',2'-dimethyl-2'H-(3,6')bi(1-benzopyranyl)-4-one	ChemIDplus
5,7-dihydroxy-3-(8-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-4H-1-benzopyran-4-one	HMDB

Last Modified

16 January 2014