| Name |
Ascalonicoside B |
| Formula |
C45H72O18 |
| Mw |
900.4718655 |
| CAS RN |
473555-60-1 |
| C_ID |
C00055263
|
| InChIKey |
LXYJZECGEIAZOD-GITVNLFTSA-N |
| InChICode |
InChI=1S/C45H72O18/c1-18(17-57-43-40(37(54)34(51)29(16-47)61-43)63-41-38(55)35(52)32(49)20(3)58-41)6-9-26-19(2)31-27(59-26)14-25-23-8-7-21-12-22(48)13-30(45(21,5)24(23)10-11-44(25,31)4)62-42-39(56)36(53)33(50)28(15-46)60-42/h7,18,20,22-25,27-43,46-56H,6,8-17H2,1-5H3/t18-,20+,22-,23-,24+,25+,27+,28-,29-,30-,31+,32+,33+,34-,35-,36+,37+,38-,39-,40-,41+,42+,43-,44+,45+/m1/s1 |
| SMILES |
CC1=C(CC[C@@H](C)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)O[C@H]2C[C@H]3[C@@H]4CC=C5C[C@@H](O)C[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Alliaceae | Allium asacalonicum | Ref. |
| Plantae | Alliaceae | Allium ascalonicum  | Ref. |
|
|
zoom in
| Organism | Allium ascalonicum |
|---|
| Reference | Shevchuk, G.V. et al., Chem. Nat. Compd. (Engl. Transl.), 1991, 27, 706-711 (Nolinofurosides) |
|---|
|
