| Name |
Withanolide S |
| Formula |
C28H40O8 |
| Mw |
504.27231825 |
| CAS RN |
63139-16-2 |
| C_ID |
C00064453
|
| InChIKey |
PQZVBIJEPVKNOZ-UHFFFAOYSA-N |
| InChICode |
InChI=1S/C28H40O8/c1-15-13-21(36-22(31)16(15)2)25(5,32)28(35)12-11-26(33)18-14-20(30)27(34)9-6-7-19(29)24(27,4)17(18)8-10-23(26,28)3/h6-7,17-18,20-21,30,32-35H,8-14H2,1-5H3 |
| SMILES |
CC1=C(C)C(=O)OC(C(C)(O)C2(O)CCC3(O)C4CC(O)C5(O)CC=CC(=O)C5(C)C4CCC32C)C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Solanaceae | Withania somnifera  | Ref. |
|
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