| Name |
Caucasicoside B
(-)-Caucasicoside B |
| Formula |
C45H70O19 |
| Mw |
914.45113006 |
| CAS RN |
1011527-17-5 |
| C_ID |
C00033702
, 
|
| InChIKey |
GWNCJTZKIAESFW-LJOBCBAFNA-N |
| InChICode |
InChI=1S/C45H70O19/c1-17(16-58-41-38(56)36(54)33(51)27(14-46)62-41)6-9-25-18(2)30-26(61-25)12-23-22-8-7-20-10-21(11-29(49)45(20,5)31(22)24(48)13-44(23,30)4)60-43-40(37(55)34(52)28(15-47)63-43)64-42-39(57)35(53)32(50)19(3)59-42/h7,19,21-24,26-43,46-57H,1,6,8-16H2,2-5H3/t19-,21+,22-,23-,24+,26-,27+,28+,29+,30-,31+,32-,33-,34-,35+,36-,37-,38+,39+,40+,41+,42-,43+,44-,45+/m0/s1 |
| SMILES |
C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2([C@@H]1O)C)[C@@H](C[C@]1([C@H]3C[C@H]2[C@@H]1C(=C(O2)CCC(=C)CO[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)C)C)O)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Ranunculaceae | Helleborus caucasicus | Ref. |
|
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