| Name |
Betavulgaroside VI |
| Formula |
C47H72O21 |
| Mw |
972.45660937 |
| CAS RN |
178535-50-7 |
| C_ID |
C00054995
|
| InChIKey |
RUORMQGDEFZFBR-YTSKFGRQSA-N |
| InChICode |
InChI=1S/C47H72O21/c1-42(2)13-15-47(41(62)68-39-30(54)29(53)28(52)23(18-48)64-39)16-14-45(5)21(22(47)17-42)7-8-25-43(3)11-10-26(44(4,20-49)24(43)9-12-46(25,45)6)65-40-32(56)34(31(55)35(67-40)37(60)61)66-38(33(57)36(58)59)63-19-27(50)51/h7,22-26,28-35,38-40,48-49,52-57H,8-20H2,1-6H3,(H,50,51)(H,58,59)(H,60,61)/t22-,23+,24+,25+,26-,28+,29-,30+,31-,32+,33+,34-,35-,38-,39-,40+,43-,44-,45+,46+,47-/m0/s1 |
| SMILES |
CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@H](OCC(=O)O)[C@H](O)C(=O)O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Caryophyllales | Beta vulgaris  | Ref. |
|
|
zoom in
| Organism | Beta vulgaris |
|---|
| Reference | Mzhel'skaya, L.G. et al., Chem. Nat. Compd. (Engl. Transl.), 1966, 2, 345-348
1968, 4, 132-135
1968, 4, 186-189 (Leontosides D,E) |
|---|
|
