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CHEBI:32082 - quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside
| Formula | C27H30O17 |
| Net Charge | 0 |
| Average Mass | 626.520 |
| Monoisotopic Mass | 626.14830 |
| SMILES | O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 |
| InChI | InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1 |
| InChIKey | RDUAJIJVNHKTQC-UJECXLDQSA-N |
| Roles Classification |
|---|
| Chemical Role: | antioxidant A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. |
| Biological Role: | 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 Relation(s) |
| quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) has role antioxidant (CHEBI:22586) |
| quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) has role plant metabolite (CHEBI:76924) |
| quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) is a sophoroside (CHEBI:145470) |
| quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) is a tetrahydroxyflavone (CHEBI:38684) |
| quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) is conjugate acid of quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside(1−) (CHEBI:144438) |
| Incoming Relation(s) |
| quercetin 3-O-[(6-O-caffeoyl-β-D-glucosyl)-(1→2)-β-D-glucoside] (CHEBI:145787) has functional parent quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) |
| quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside(1−) (CHEBI:144438) is conjugate base of quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) |
| IUPAC Name |
|---|
| 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside |
| Synonyms | Source |
|---|---|
| Baimaside | KEGG COMPOUND |
| Quercetin 3-beta-D-sophoroside | KEGG COMPOUND |
| Quercetin 3-O-sophoroside | KEGG COMPOUND |
| QUOSP | KEGG COMPOUND |
| 2-(3,4-dihydroxyphenyl)-3-((2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy)-5,7-dihydroxy-4H-1-benzopyran-4-one | ChemIDplus |
| Registry Numbers | Sources |
|---|---|
| Reaxys:1278846 | Reaxys |
| CAS:18609-17-1 | KEGG COMPOUND |
| CAS:18609-17-1 | ChemIDplus |
| Citations |
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