| Name |
Quercetin 3-(2'''-(E)-caffeylsophoroside]-7-glucoside |
| Formula |
C42H46O25 |
| Mw |
950.23281702 |
| CAS RN |
151649-67-1 |
| C_ID |
C00005996
, 
|
| InChIKey |
QBXRXORKIXERDE-HKFQEAKLNA-N |
| InChICode |
InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1 |
| SMILES |
c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)OC(=O)/C=C/c1cc(c(cc1)O)O)c1ccc(c(c1)O)O)O)O[C@@H]1O[C@H]([C@H]([C@@H]([C@H]1O)O)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cruciferae | Brassica oleracea  | Ref. |
| Plantae | Ranunculaceae | Ranunculus biternatus | Ref. |
| Plantae | Ranunculaceae | Ranunculus moseleyi | Ref. |
| Plantae | Ranunculaceae | Ranunculus pseudotrullifolius | Ref. |
|
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