| Name |
Ascalonicoside C |
| Formula |
C45H74O21 |
| Mw |
950.47225943 |
| CAS RN |
953782-43-9 |
| C_ID |
C00054968
|
| InChIKey |
ZLLYYBOKCSEYTP-OFMYGBPTSA-N |
| InChICode |
InChI=1S/C45H74O21/c1-17(16-60-39-35(55)31(51)29(49)26(14-46)62-39)6-9-45(59)19(3)28-24(66-45)11-22-20-10-18(2)44(58)13-25(23(48)12-43(44,5)21(20)7-8-42(22,28)4)61-41-37(33(53)30(50)27(15-47)63-41)64-40-36(56)32(52)34(54)38(57)65-40/h17-22,24-41,46-47,49-59H,6-16H2,1-5H3/t17-,18-,19+,20-,21+,22+,24+,25-,26-,27-,28+,29-,30-,31+,32-,33+,34-,35-,36-,37-,38-,39-,40-,41-,42+,43-,44+,45-/m1/s1 |
| SMILES |
C[C@H](CC[C@@]1(O)O[C@H]2C[C@H]3[C@@H]4C[C@@H](C)[C@@]5(O)C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@@H](O)[C@H](O)[C@@H](O)[C@H]6O)C(=O)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2[C@@H]1C)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Alliaceae | Allium ascalonicum  | Ref. |
|
|
zoom in
| Organism | Allium ascalonicum |
|---|
| Reference | Mimaki, Y. et al., Chem. Pharm. Bull., 1994, 42, 710-714 (Allium giganteum constits) |
|---|
|
