| Name |
Tragopogonsaponin K |
| Formula |
C50H72O15 |
| Mw |
912.48712163 |
| CAS RN |
134361-71-0 |
| C_ID |
C00057856
|
| InChIKey |
MTYGCVPOKVNXNH-XNTDXEJSSA-N |
| InChICode |
InChI=1S/C50H72O15/c1-45(2)20-21-50(29(22-45)28-13-14-33-47(5)18-17-34(54)46(3,4)32(47)16-19-48(33,6)49(28,7)23-35(50)55)44(60)65-43-41(63-36(56)15-10-26-8-11-27(52)12-9-26)40(30(53)25-61-43)64-42-39(59)38(58)37(57)31(24-51)62-42/h8-13,15,29-35,37-43,51-55,57-59H,14,16-25H2,1-7H3/b15-10+ |
| SMILES |
CC1(C)CCC2(C(=O)OC3OCC(O)C(OC4OC(CO)C(O)C(O)C4O)C3OC(=O)/C=C/c3ccc(O)cc3)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Tragopogon porrifolius  | Ref. |
|
|
zoom in
| Organism | Tragopogon porrifolius |
|---|
| Reference | Frazier, D. et al., JACS, 1944, 66, 1267-1268 (struct) |
|---|
|
