CHEBI:65934 - furowanin B

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name furowanin B
ChEBI ID CHEBI:65934
Definition A hydroxyisoflavone that is 8,9-dihydro-4H-furo[2,3-h]chromen-4-one substituted by a hydroxy group at position 5, a 3,4-dihydroxyphenyl group at position 3, a 2-hydroxypropan-2-yl group at position 8 and a prenyl group at position 6. Isolated from Millettia pachycarpa, it exhibits anti-estrogenic activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C25H26O7
Net Charge 0
Average Mass 438.46970
Monoisotopic Mass 438.16785
InChI InChI=1S/C25H26O7/c1-12(2)5-7-14-21(28)20-22(29)16(13-6-8-17(26)18(27)9-13)11-31-24(20)15-10-19(25(3,4)30)32-23(14)15/h5-6,8-9,11,19,26-28,30H,7,10H2,1-4H3
InChIKey YOKJEIDBLPWOSL-UHFFFAOYSA-N
SMILES CC(C)=CCc1c(O)c2c(occ(-c3ccc(O)c(O)c3)c2=O)c2CC(Oc12)C(C)(C)O
Metabolite of Species Details
Millettia pachycarpa (NCBI:txid690557) Found in leaf (BTO:0000713). 11:10 enantiomeric mixture See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application(s): anti-estrogen
A drug which acts to reduce estrogenic activity in the body, either by reducing the amount of estrogen or by reducing the activity of whatever estrogen is present.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing furowanin B (CHEBI:65934) has role anti-estrogen (CHEBI:50751)
furowanin B (CHEBI:65934) has role metabolite (CHEBI:25212)
furowanin B (CHEBI:65934) is a hydroxyisoflavone (CHEBI:38755)
furowanin B (CHEBI:65934) is a tertiary alcohol (CHEBI:26878)
IUPAC Name
3-(3,4-dihydroxyphenyl)-5-hydroxy-8-(2-hydroxypropan-2-yl)-6-(3-methylbut-2-en-1-yl)-8,9-dihydro-4H-furo[2,3-h]chromen-4-one
Registry Number Type Source
18586899 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
16441086 PubMed citation Europe PMC
Last Modified
02 August 2013