| Name |
Smilaxin A |
| Formula |
C38H60O13 |
| Mw |
724.403392 |
| CAS RN |
123941-70-8 |
| C_ID |
C00057832
|
| InChIKey |
DHRMNCARLQBGJF-SIXKPJINSA-N |
| InChICode |
InChI=1S/C38H60O13/c1-17-5-10-38(48-14-17)18(2)28-26(51-38)13-22-20-12-24(39)23-11-19(6-8-36(23,3)21(20)7-9-37(22,28)4)49-35-33(45)31(43)30(42)27(50-35)16-47-34-32(44)29(41)25(40)15-46-34/h17-23,25-35,40-45H,5-16H2,1-4H3/t17-,18+,19+,20-,21+,22+,23-,25+,26+,27-,28+,29+,30-,31+,32-,33-,34+,35-,36-,37+,38-/m1/s1 |
| SMILES |
C[C@@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC(=O)[C@H]5C[C@@H](O[C@@H]6O[C@H](CO[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Alliaceae | Allium chinense  | Ref. |
|
|
zoom in
| Organism | Allium chinense |
|---|
| Reference | Akahori, A. et al., Chem. Pharm. Bull., 1965, 13, 545 |
|---|
|
