CHEBI:69741 - mucusisoflavone A

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ChEBI Name mucusisoflavone A
ChEBI ID CHEBI:69741
Definition A hydroxyisoflavone, isoflavone dimer obtained from Ficus mucuso.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C40H32O10
Net Charge 0
Average Mass 672.67610
Monoisotopic Mass 672.19955
InChI InChI=1S/C40H32O10/c1-20-7-9-40(2,10-8-23-12-21(3-5-30(23)43)27-18-49-34-16-24(41)14-32(45)36(34)38(27)47)29(11-20)26-13-22(4-6-31(26)44)28-19-50-35-17-25(42)15-33(46)37(35)39(28)48/h3-6,8,10-19,29,41-46H,7,9H2,1-2H3/b10-8+/t29-,40+/m1/s1
InChIKey UXLMHNXEKOQLBQ-DCAFODOZSA-N
SMILES CC1=C[C@H](c2cc(ccc2O)-c2coc3cc(O)cc(O)c3c2=O)[C@@](C)(CC1)\C=C\c1cc(ccc1O)-c1coc2cc(O)cc(O)c2c1=O
Metabolite of Species Details
Ficus mucuso (NCBI:txid309328) Found in fruit (BTO:0000486). Methanolic extract of air-dried and powdered figs(fruits) See: PubMed
Roles Classification
Biological Role(s): EC 3.2.1.31 (beta-glucuronidase) inhibitor
An EC 3.2.1.* (glycosidase) inhibitor that interferes with the action of beta-glucuronidase (EC 3.2.1.31).
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing mucusisoflavone A (CHEBI:69741) has role EC 3.2.1.31 (β-glucuronidase) inhibitor (CHEBI:76822)
mucusisoflavone A (CHEBI:69741) has role plant metabolite (CHEBI:76924)
mucusisoflavone A (CHEBI:69741) is a hydroxyisoflavone (CHEBI:38755)
IUPAC Name
rel-3-(3-{(E)-2-[(1S,2S)-5'-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl)-2'-hydroxy-2,5-dimethyl[1,2,3,4-tetrahydro[1,1'-biphenyl]]-2-yl]ethenyl}-4-hydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
Registry Number Type Source
21646916 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21619045 PubMed citation Europe PMC
Last Modified
24 June 2015