| Name |
Quercetin 3-(3R-glucosylrutinoside) |
| Formula |
C33H40O21 |
| Mw |
772.20620834 |
| CAS RN |
136449-10-0 |
| C_ID |
C00005448
, 
|
| InChIKey |
XEFNBVWDOQCMSG-HGXRSFPYNA-N |
| InChICode |
InChI=1S/C33H40O21/c1-9-19(39)29(53-32-25(45)23(43)20(40)16(7-34)51-32)27(47)31(49-9)48-8-17-21(41)24(44)26(46)33(52-17)54-30-22(42)18-14(38)5-11(35)6-15(18)50-28(30)10-2-3-12(36)13(37)4-10/h2-6,9,16-17,19-21,23-27,29,31-41,43-47H,7-8H2,1H3/t9-,16-,17-,19+,20-,21-,23+,24+,25-,26-,27-,29+,31-,32+,33+/m1/s1 |
| SMILES |
CC1O[C@@H](OCC2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)C(O)C(O)[C@@H]2O)C(O)[C@@H](O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Theaceae | Camellia sinensis  | Ref. |
|
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