| Name |
Macedonoside A |
| Formula |
C42H62O17 |
| Mw |
838.39870056 |
| CAS RN |
256441-31-3 |
| C_ID |
C00061113
|
| InChIKey |
YMGDWMUJTLAHDV-XQBNMYAKSA-N |
| InChICode |
InChI=1S/C42H62O17/c1-37(2)20-8-11-42(7)31(19(43)14-17-18-15-40(5,36(54)55)21(44)16-38(18,3)12-13-41(17,42)6)39(20,4)10-9-22(37)56-35-30(26(48)25(47)29(58-35)33(52)53)59-34-27(49)23(45)24(46)28(57-34)32(50)51/h14,18,20-31,34-35,44-49H,8-13,15-16H2,1-7H3,(H,50,51)(H,52,53)(H,54,55)/t18-,20-,21+,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35+,38-,39-,40-,41+,42+/m0/s1 |
| SMILES |
CC12CCC3(C)C(=CC(=O)C4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6OC(C(=O)O)C(O)C(O)C6O)C(C)(C)C5CCC43C)C1CC(C)(C(=O)O)C(O)C2 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Glycyrrhiza inflata  | Ref. |
|
|
zoom in
| Organism | Glycyrrhiza inflata |
|---|
| Reference | https://doi.org/10.3390/molecules20046273 |
|---|
|
