| Name |
Timosaponin T-N |
| Formula |
C45H76O20 |
| Mw |
936.49299487 |
| CAS RN |
1276608-20-8 |
| C_ID |
C00059549
|
| InChIKey |
QBIMZENDJORDDF-VPVPRRGQSA-N |
| InChICode |
InChI=1S/C45H76O20/c1-17(16-59-41-37(57)34(54)30(50)25(13-46)62-41)5-8-23-18(2)28-39(60-23)33(53)29-20-7-6-19-11-24(22(49)12-45(19,4)21(20)9-10-44(28,29)3)61-43-40(36(56)32(52)27(15-48)64-43)65-42-38(58)35(55)31(51)26(14-47)63-42/h17-43,46-58H,5-16H2,1-4H3/t17-,18+,19+,20+,21-,22?,23?,24+,25+,26+,27+,28-,29+,30+,31+,32-,33-,34-,35-,36-,37+,38+,39+,40+,41+,42-,43+,44+,45-/m0/s1 |
| SMILES |
CC(CCC1OC2C(O)C3C4CCC5CC(OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(O)CC5(C)C4CCC3(C)C2C1C)COC1OC(CO)C(O)C(O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Phellodendron amurense  | Ref. |
|
|
zoom in
| Organism | Phellodendron amurense |
|---|
| Reference | https://doi.org/10.1002/jssc.201300794 |
|---|
|
