| Name |
Picroroside B
(-)-Picroroside B |
| Formula |
C32H36O15 |
| Mw |
660.20542048 |
| CAS RN |
920746-10-7 |
| C_ID |
C00035148
, 
|
| InChIKey |
IKXQFQNHWKQJOI-GJRCSJLZNA-N |
| InChICode |
InChI=1S/C32H36O15/c1-41-19-11-16(8-9-18(19)33)29(39)46-28-24(35)17-12-22-43-14-32(28,40)23(17)30(45-22)47-31-27(38)26(37)25(36)20(44-31)13-42-21(34)10-7-15-5-3-2-4-6-15/h2-11,17,20,22-28,30-31,33,35-38,40H,12-14H2,1H3/b10-7+/t17?,20-,22?,23?,24+,25-,26+,27-,28-,30+,31+,32-/m1/s1 |
| SMILES |
O1[C@H]2OC[C@]3([C@@H]([C@@H]1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)COC(=O)/C=C/c1ccccc1)[C@H]([C@@H]([C@H]3OC(=O)c1cc(c(cc1)O)OC)O)C2)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Plantaginaceae | Neopicrorhiza scrophulariiflora  | Ref. |
|
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