| Name |
Inflasaponin I |
| Formula |
C47H72O16 |
| Mw |
892.48203625 |
| CAS RN |
158511-51-4 |
| C_ID |
C00050826
|
| InChIKey |
QWDAXORUTKNFPM-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C47H72O16/c1-10-11-20-59-38(55)34-30(51)31(52)35(63-39-32(53)28(49)29(50)33(61-39)37(54)58-9)40(62-34)60-27-13-14-45(6)26(42(27,2)3)12-15-47(8)36(45)25(48)21-23-24-22-44(5,41(56)57)17-16-43(24,4)18-19-46(23,47)7/h21,24,26-36,39-40,49-53H,10-20,22H2,1-9H3,(H,56,57)/t24-,26-,27-,28-,29-,30-,31-,32+,33-,34-,35+,36+,39-,40+,43+,44-,45-,46+,47+/m0/s1 |
| SMILES |
CCCCOC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3C(=O)C=C3C5CC(C)(OC=O)CCC5(C)CCC34C)C2(C)C)C(OC2OC(C(=O)OC)C(O)C(O)C2O)C(O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Glycyrrhiza inflata  | Ref. |
|
|
zoom in
| Organism | Glycyrrhiza inflata |
|---|
| Reference | Zou, et al., Acta Pharmaceutica Sinica(Yaoxue Xuebao), 29, (1994), 393 |
|---|
|
