| Name |
3beta-Hydroxy-5alpha-pregn-16-en-20-one 3-O-beta-lycotetraoside |
| Formula |
C44H70O21 |
| Mw |
934.4409593 |
| CAS RN |
39941-71-4 |
| C_ID |
C00061712
|
| InChIKey |
SFXXKNRRGZAKBZ-OASMDILCSA-N |
| InChICode |
InChI=1S/C44H70O21/c1-17(48)21-6-7-22-20-5-4-18-12-19(8-10-43(18,2)23(20)9-11-44(21,22)3)59-40-35(57)32(54)36(27(15-47)62-40)63-42-38(65-41-34(56)31(53)29(51)25(13-45)60-41)37(30(52)26(14-46)61-42)64-39-33(55)28(50)24(49)16-58-39/h6,18-20,22-42,45-47,49-57H,4-5,7-16H2,1-3H3/t18-,19-,20-,22-,23-,24+,25+,26+,27+,28-,29+,30+,31-,32+,33+,34+,35+,36-,37-,38+,39-,40+,41-,42-,43-,44+/m0/s1 |
| SMILES |
CC(=O)C1=CCC2C3CCC4CC(OC5OC(CO)C(OC6OC(CO)C(O)C(OC7OCC(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(O)C5O)CCC4(C)C3CCC12C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Solanaceae | Solanum lycopersicum  | Ref. |
|
|
zoom in
| Organism | Solanum lycopersicum |
|---|
| Reference | https://doi.org/10.1021/np100311t |
|---|
|
