| Name |
Withanamide A |
| Formula |
C40H62N2O13 |
| Mw |
778.42519008 |
| CAS RN |
702702-22-5 |
| C_ID |
C00026604
, 
|
| InChIKey |
ZWPVRCFACRKFAE-IPFBORAENA-N |
| InChICode |
InChI=1S/C40H62N2O13/c1-25(44)15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-32(45)41-20-19-26-22-42-29-18-17-27(21-28(26)29)53-40-38(51)36(49)34(47)31(55-40)24-52-39-37(50)35(48)33(46)30(23-43)54-39/h2-3,6,8,17-18,21-22,25,30-31,33-40,42-44,46-51H,4-5,7,9-16,19-20,23-24H2,1H3,(H,41,45)/b3-2-,8-6-/t25-,30+,31+,33+,34+,35+,36-,37-,38-,39+,40+/m0/s1 |
| SMILES |
O1[C@@H](OC[C@H]2O[C@@H](Oc3ccc4c(c3)c(c[nH]4)CCNC(=O)CCCC/C=C\C/C=C\CCCCCC[C@H](C)O)[C@@H](O)[C@H]([C@@H]2O)O)[C@@H](O)[C@@H]([C@@H]([C@H]1CO)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Pro L-Lys |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Solanaceae | Withania somnifera  | Ref. |
|
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