| Name |
Batatinoside V |
| Formula |
C56H98O23 |
| Mw |
1138.64988944 |
| CAS RN |
1072160-33-8 |
| C_ID |
C00055029
|
| InChIKey |
DNJSTYCGWNYCKP-FFIHMIDVSA-N |
| InChICode |
InChI=1S/C56H98O23/c1-8-10-12-13-15-19-24-28-36(58)75-51-50(79-53-44(66)41(63)38(60)30(4)69-53)47(77-52-43(65)40(62)37(59)29(3)68-52)33(7)72-56(51)76-46-32(6)71-55-49(45(46)67)74-35(57)27-23-20-17-14-16-18-22-26-34(25-21-11-9-2)73-54-48(78-55)42(64)39(61)31(5)70-54/h29-34,37-56,59-67H,8-28H2,1-7H3/t29-,30-,31+,32-,33-,34-,37-,38-,39-,40+,41+,42-,43+,44+,45+,46-,47-,48+,49+,50+,51+,52-,53-,54-,55-,56-/m0/s1 |
| SMILES |
CCCCCCCCCC(=O)O[C@H]1[C@H](O[C@@H]2[C@@H](O)[C@H]3OC(=O)CCCCCCCCC[C@H](CCCCC)O[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@H]4O[C@@H]3O[C@H]2C)O[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Convolvulaceae | Ipomoea batatas  | Ref. |
|
|
zoom in
| Organism | Ipomoea batatas |
|---|
| Reference | Noda, N. et al., Chem. Pharm. Bull., 1992, 40, 3163-3168 (Simonins II-V) |
|---|
|
