| Name |
Sandrosaponin VI
(+)-Sandrosaponin VI |
| Formula |
C48H78O22S |
| Mw |
1038.47054491 |
| CAS RN |
308358-86-3 |
| C_ID |
C00037788
, 
|
| InChIKey |
ZZEVXJGMALBHKL-OXHZOMGANA-N |
| InChICode |
InChI=1S/C48H78O22S/c1-22-31(55)38(68-41-36(60)34(58)37(26(18-50)66-41)70-71(61,62)63)39(69-40-35(59)33(57)32(56)25(17-49)65-40)42(64-22)67-30-10-11-44(3)27(45(30,4)20-52)9-12-46(5)28(44)8-7-23-24-15-43(2,19-51)13-14-48(24,21-53)29(54)16-47(23,46)6/h7-8,22,25-42,49-60H,9-21H2,1-6H3,(H,61,62,63)/t22-,25-,26-,27-,28-,29-,30+,31+,32-,33+,34-,35-,36-,37-,38+,39-,40+,41+,42+,43-,44+,45+,46-,47-,48-/m1/s1 |
| SMILES |
C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C=CC3=C5C[C@](C)(CO)CC[C@]5(CO)[C@H](O)C[C@]34C)[C@]2(C)CO)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](OS(=O)(=O)O)[C@H](O)[C@H]2O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apiaceae | Bupleurum rigidum L. | Ref. |
|
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