| Name |
Soyasaponin Bx |
| Formula |
C47H76O18 |
| Mw |
928.50316563 |
| CAS RN |
152505-07-2 |
| C_ID |
C00057915
|
| InChIKey |
ASEXQTNYKZSXFR-VQZQZUFQSA-N |
| InChICode |
InChI=1S/C47H76O18/c1-42(2)16-22-21-8-9-26-44(4)12-11-28(45(5,20-49)25(44)10-13-47(26,7)46(21,6)15-14-43(22,3)27(51)17-42)62-41-37(33(56)32(55)35(63-41)38(58)59)65-40-36(29(52)23(50)19-60-40)64-39-34(57)31(54)30(53)24(18-48)61-39/h8,22-37,39-41,48-57H,9-20H2,1-7H3,(H,58,59)/t22-,23-,24+,25+,26+,27+,28-,29-,30+,31-,32-,33-,34+,35-,36+,37+,39-,40-,41+,43+,44-,45+,46+,47+/m0/s1 |
| SMILES |
CC1(C)C[C@@H](O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Glycine max  | Ref. |
|
|
zoom in
| Organism | Glycine max |
|---|
| Reference | Willner, D. et al., JCS, 1964, 5885-5888 (Soyasapogenol B, isol) |
|---|
|
