| Name |
Triptonine A |
| Formula |
C45H55NO21 |
| Mw |
945.32665783 |
| CAS RN |
226979-90-4 |
| C_ID |
C00060913
|
| InChIKey |
GHLDKPNDMMVFDQ-UHFFFAOYSA-N |
| InChICode |
InChI=1S/C45H55NO21/c1-19-13-14-28(51)27(16-29(52)58-10)41(56)60-18-44-36(63-24(6)49)32(65-38(19)53)30-34(62-23(5)48)45(44)43(9,57)35(33(61-22(4)47)37(44)64-25(7)50)66-39(54)21(3)20(2)31-26(12-11-15-46-31)40(55)59-17-42(30,8)67-45/h11-12,15,19-21,27,30,32-37,57H,13-14,16-18H2,1-10H3/t19-,20-,21-,27+,30+,32+,33-,34+,35-,36+,37-,42-,43-,44+,45-/m0/s1 |
| SMILES |
COC(=O)CC1C(=O)CCC(C)C(=O)OC2C3C(OC(C)=O)C45OC3(C)COC(=O)c3cccnc3C(C)C(C)C(=O)OC(C(OC(C)=O)C(OC(C)=O)C4(COC1=O)C2OC(C)=O)C5(C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Celastraceae | Tripterygium wilfordii  | Ref. |
|
|
zoom in
| Organism | Tripterygium wilfordii |
|---|
| Reference | https://doi.org/10.1021/np000504a
https://doi.org/10.1021/np990281s |
|---|
|
