| Name |
Cynarasaponin D |
| Formula |
C47H74O19 |
| Mw |
942.48243018 |
| CAS RN |
117804-10-1 |
| C_ID |
C00054723
|
| InChIKey |
QHWJYYBRVQGYAR-DLCGRDDYSA-N |
| InChICode |
InChI=1S/C47H74O19/c1-20-9-14-47(42(60)66-40-35(57)31(53)30(52)24(17-48)62-40)16-15-45(5)22(28(47)21(20)2)7-8-26-43(3)12-11-27(44(4,19-49)25(43)10-13-46(26,45)6)63-41-37(33(55)32(54)36(64-41)38(58)59)65-39-34(56)29(51)23(50)18-61-39/h7,20-21,23-37,39-41,48-57H,8-19H2,1-6H3,(H,58,59)/t20-,21+,23+,24-,25-,26-,27+,28+,29+,30-,31+,32+,33+,34-,35-,36+,37-,39+,40+,41-,43+,44+,45-,46-,47+/m1/s1 |
| SMILES |
C[C@H]1[C@H](C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Cynara cardunculus  | Ref. |
|
|
zoom in
| Organism | Cynara cardunculus |
|---|
| Reference | Kikuchi, T. et al., Chem. Pharm. Bull., 1984, 32, 3906-3911 (isol, struct) |
|---|
|
