| Name |
Bacopasaponin B |
| Formula |
C40H64O12 |
| Mw |
736.43977751 |
| CAS RN |
178064-12-5 |
| C_ID |
C00029768
, 
|
| InChIKey |
GHWPFBAAEVCXOY-JMLFOLFTNA-N |
| InChICode |
InChI=1S/C40H64O12/c1-20(2)14-21-16-48-40-18-39(19-49-40)22(32(40)38(21,7)46)8-9-26-36(5)12-11-27(35(3,4)25(36)10-13-37(26,39)6)51-34-31(28(43)23(42)17-47-34)52-33-30(45)29(44)24(15-41)50-33/h14,21-34,41-46H,8-13,15-19H2,1-7H3/t21-,22-,23+,24+,25+,26-,27+,28+,29+,30-,31-,32+,33+,34+,36+,37-,38+,39+,40-/m1/s1 |
| SMILES |
CC(C)=C[C@@H]1CO[C@]23C[C@]4(CO2)[C@H](CC[C@@H]2[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@@H](CO)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]24C)C3[C@@]1(C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Plantaginaceae | Bacopa monnieri  | Ref. |
|
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