| Name |
Asiaticoside E |
| Formula |
C42H68O15 |
| Mw |
812.4558215 |
| CAS RN |
851222-51-0 |
| C_ID |
C00055124
|
| InChIKey |
QRECZCMVJKJLJW-JNGPRRAUSA-N |
| InChICode |
InChI=1S/C42H68O15/c1-19-9-12-42(37(53)57-36-33(51)31(49)29(47)24(56-36)17-54-35-32(50)30(48)28(46)23(16-43)55-35)14-13-40(5)21(27(42)20(19)2)7-8-26-38(3)15-22(45)34(52)39(4,18-44)25(38)10-11-41(26,40)6/h7,19-20,22-36,43-52H,8-18H2,1-6H3/t19-,20+,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,32-,33-,34+,35-,36+,38+,39+,40-,41-,42+/m1/s1 |
| SMILES |
C[C@H]1[C@H](C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Araliaceae | Centella asiatica  | Ref. |
|
|
zoom in
| Organism | Centella asiatica |
|---|
| Reference | Polonsky, J. et al., Bull. Soc. Chim. Fr., 1959, 880-887
1961, , 1586-1591 (Asiatic acid, Asiaticoside, isol, struct) |
|---|
|
