CHEBI:86334 - (3R)-7,2'-dihydroxy-3',4'-dimethoxyisoflavan-7-O-β-D-glucopyranoside

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ChEBI Name (3R)-7,2'-dihydroxy-3',4'-dimethoxyisoflavan-7-O-β-D-glucopyranoside
ChEBI ID CHEBI:86334
ChEBI ASCII Name (3R)-7,2'-dihydroxy-3',4'-dimethoxyisoflavan-7-O-beta-D-glucopyranoside
Definition A monosaccharide derivative that is (R)-isoflavan substituted by a hydroxy group substituted at position 2', methoxy groups at positions 3' and 4' and a β-D-glucopyranosyloxy group at position 7 respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C23H28O10
Net Charge 0
Average Mass 464.46240
Monoisotopic Mass 464.16825
InChI InChI=1S/C23H28O10/c1-29-15-6-5-14(18(25)22(15)30-2)12-7-11-3-4-13(8-16(11)31-10-12)32-23-21(28)20(27)19(26)17(9-24)33-23/h3-6,8,12,17,19-21,23-28H,7,9-10H2,1-2H3/t12-,17+,19+,20-,21+,23+/m0/s1
InChIKey SXHOGLPTLQBGDO-ZVSSUSCDSA-N
SMILES COc1ccc([C@@H]2COc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3C2)c(O)c1OC
Metabolite of Species Details
Astragalus mongholicus (NCBI:txid119829) See: MetaboLights Study
Astragalus mongholicus (NCBI:txid119829) See: PubMed
Roles Classification
Biological Role(s): 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 (3R)-7,2'-dihydroxy-3',4'-dimethoxyisoflavan-7-O-β-D-glucopyranoside (CHEBI:86334) has parent hydride (R)-isoflavan (CHEBI:36101)
(3R)-7,2'-dihydroxy-3',4'-dimethoxyisoflavan-7-O-β-D-glucopyranoside (CHEBI:86334) has role plant metabolite (CHEBI:76924)
(3R)-7,2'-dihydroxy-3',4'-dimethoxyisoflavan-7-O-β-D-glucopyranoside (CHEBI:86334) is a β-D-glucoside (CHEBI:22798)
(3R)-7,2'-dihydroxy-3',4'-dimethoxyisoflavan-7-O-β-D-glucopyranoside (CHEBI:86334) is a hydroxyisoflavans (CHEBI:76250)
(3R)-7,2'-dihydroxy-3',4'-dimethoxyisoflavan-7-O-β-D-glucopyranoside (CHEBI:86334) is a methoxyisoflavan (CHEBI:77002)
(3R)-7,2'-dihydroxy-3',4'-dimethoxyisoflavan-7-O-β-D-glucopyranoside (CHEBI:86334) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name
(3R)-3-(2-hydroxy-3,4-dimethoxyphenyl)-3,4-dihydro-2H-1-benzopyran-7-yl β-D-glucopyranoside
Synonym Source
isomucronulatol 7-O-β-D-glucoside ChEBI
Registry Number Type Source
20966873 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
25844502 PubMed citation Europe PMC
Last Modified
22 January 2016