| Name |
Bacoside A3 |
| Formula |
C47H76O18 |
| Mw |
928.50316563 |
| CAS RN |
157408-08-7 |
| C_ID |
C00029784
, 
|
| InChIKey |
CDEVGTJBRPBOPH-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C47H76O18/c1-21(2)14-22-15-45(7,57)38-23-8-9-28-43(5)12-11-29(42(3,4)27(43)10-13-44(28,6)46(23)19-47(38,65-22)58-20-46)62-41-37(64-39-34(55)31(52)25(17-49)60-39)36(32(53)26(18-50)61-41)63-40-35(56)33(54)30(51)24(16-48)59-40/h14,22-41,48-57H,8-13,15-20H2,1-7H3/t22-,23+,24+,25+,26+,27-,28+,29-,30+,31+,32-,33-,34+,35-,36+,37-,38+,39-,40-,41-,43+,44-,45-,46+,47+/m1/s1 |
| SMILES |
CC(C)=CC1CC(C)(O)C2C3CCC4C5(C)CCC(OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6OC6OC(CO)C(O)C6O)C(C)(C)C5CCC4(C)C34COC2(C4)O1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Plantaginaceae | Bacopa monnieri  | Ref. |
|
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