CHEBI:91009 - 9,10-dimethoxypterocarpan-3-O-β-D-glucoside

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ChEBI Name 9,10-dimethoxypterocarpan-3-O-β-D-glucoside
ChEBI ID CHEBI:91009
ChEBI ASCII Name 9,10-dimethoxypterocarpan-3-O-beta-D-glucoside
Definition A member of the class of pterocarpans that is 3-hydroxy-9,10-dimethoxypterocarpan in which the phenol hydrogen is replaced by a β-D-glucosyl residue.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C23H26O10
Net Charge 0
Average Mass 462.447
Monoisotopic Mass 462.15260
InChI InChI=1S/C23H26O10/c1-28-14-6-5-11-13-9-30-15-7-10(3-4-12(15)20(13)33-21(11)22(14)29-2)31-23-19(27)18(26)17(25)16(8-24)32-23/h3-7,13,16-20,23-27H,8-9H2,1-2H3/t13?,16-,17-,18+,19-,20?,23-/m1/s1
InChIKey PCIXSTFFMHVOMF-NFOIBEGASA-N
SMILES C12C(C=3C=CC(=C(C3O1)OC)OC)COC4=C2C=CC(=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O
Metabolite of Species Details
Astragalus mongholicus (NCBI:txid119829) See: PubMed
Astragalus mongholicus (NCBI:txid119829) See: MetaboLights Study
Astragalus mongholicus (NCBI:txid119829) Found in root (BTO:0001188). 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 9,10-dimethoxypterocarpan-3-O-β-D-glucoside (CHEBI:91009) has role plant metabolite (CHEBI:76924)
9,10-dimethoxypterocarpan-3-O-β-D-glucoside (CHEBI:91009) is a β-D-glucoside (CHEBI:22798)
9,10-dimethoxypterocarpan-3-O-β-D-glucoside (CHEBI:91009) is a aromatic ether (CHEBI:35618)
9,10-dimethoxypterocarpan-3-O-β-D-glucoside (CHEBI:91009) is a monosaccharide derivative (CHEBI:63367)
9,10-dimethoxypterocarpan-3-O-β-D-glucoside (CHEBI:91009) is a pterocarpans (CHEBI:26377)
IUPAC Name
9,10-dimethoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c][1]benzopyran-3-yl β-D-glucopyranoside
Registry Number Type Source
27695500 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
15763368 PubMed citation Europe PMC
25844502 PubMed citation Europe PMC
Last Modified
25 January 2016