| Name |
Cassialoin |
| Formula |
C21H22O9 |
| Mw |
418.1263823 |
| CAS RN |
60462-09-1 |
| C_ID |
C00031656
, 
|
| InChIKey |
UQFYMIDDRRJKBM-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C21H22O9/c1-8-5-10-15(12(24)6-8)17(26)14-9(3-2-4-11(14)23)21(10,29)20-19(28)18(27)16(25)13(7-22)30-20/h2-6,13,16,18-20,22-25,27-29H,7H2,1H3/t13-,16-,18+,19-,20-,21-/m1/s1 |
| SMILES |
c12c(C(=O)c3c([C@@]1([C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)cccc3O)c(cc(c2)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Polygonaceae | Rheum emodi  | Ref. |
|
|
zoom in
| Organism | Rheum emodi |
|---|
| Reference | Krenn,Chem.Pharm.Bull.,52,(2004),391 |
|---|
|
