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CHEBI:140107 - quercetin 3-glucoside-3'-sulfate
| Formula | C21H20O15S |
| Net Charge | 0 |
| Average Mass | 544.443 |
| Monoisotopic Mass | 544.05229 |
| SMILES | O=c1c(O[C@@H]2OC(CO)[C@@H](O)C(O)[C@@H]2O)c(-c2ccc(O)c(OS(=O)(=O)O)c2)oc2cc(O)cc(O)c12 |
| InChI | InChI=1S/C21H20O15S/c22-6-13-15(26)17(28)18(29)21(34-13)35-20-16(27)14-10(25)4-8(23)5-12(14)33-19(20)7-1-2-9(24)11(3-7)36-37(30,31)32/h1-5,13,15,17-18,21-26,28-29H,6H2,(H,30,31,32)/t13?,15-,17?,18+,21+/m1/s1 |
| InChIKey | YXZPJASIVFGNHX-OBLDEXFVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| quercetin 3-glucoside-3'-sulfate (CHEBI:140107) is a flavonoids (CHEBI:72544) |
| quercetin 3-glucoside-3'-sulfate (CHEBI:140107) is a glycoside (CHEBI:24400) |
| Manual Xrefs | Databases |
|---|---|
| LMPK12112280 | LIPID MAPS |