Table 2.
S.No. | Phytochemicals | Pubchem Id | Binding energy (kcal/mol) | Molecular weight (g/mol) | Part of Plant used | Structure of Phytochemical | Nature | References |
---|---|---|---|---|---|---|---|---|
1. | Tropine | 449293 | -2.54 | 141.21 | Leaves | Methanolic | Chatterjee et al. (2010); Tomar et al. (2019) | |
2. | Mesoanaferine | 443143 | -3.42 | 224.34 | Leaves | Methanolic | Cardenas et al. (2012); Kumar and Singh (2020) | |
3. | Choline | 305 | 104.17 | Leaves | Methanolic | Ahlawat et al. (2017) | ||
4. | Withanolide D | 23266147 | -8.9 | 470.6 | Leaves | Methanolic | Ben Bakrim et al., 2018 | |
5. | Withanolide O | 23266146 | -7.8 | 454.6 | Leaves | Methanolic | Khanal et al. (2020) | |
6. | Withanolide P | 21679034 | -7.7 | 468.6 | Leaves | Methanolic | Khanal et al. (2020) | |
7. | Withanolide G | 21679023 | -9.00 | 470.6 | Leaves | Alcoholic | Mousavi et al. (2021) | |
8. | Withanolide M | 25090669 | -9.1 | 652.8 | Leaves | Alcoholic | Khanal et al. (2020) | |
9. | Withanolide F | 44562999 | -7.8 | 488.6 | Leaves | Alcoholic | Khanal et al. (2020) | |
10. | Withanoside IV | 71312551 | -11.02 | 782.9 | Leaves | Butanol | Ali et al. (2022) | |
11. | Withanoside VI | 91827019 | 8.083 | 782.9 | Leaves | Methanolic | Patel et al. (2021) | |
12. | Withaferin A | 265237 | -2.85 | 470.6 | Leaves and Roots | Methanolic |
Balkrishna et al. (2020); Kumar and Singh (2020); Mohan et al. (2016); Kumar et al. (2022); Pandit and Latha (2020) |
|
13. | Withanolide D | 118701104 | -5.55 | 470.6 | Leaves and Roots | Methanolic | Khanal et al. (2020) | |
14. | Withanolide A | 11294368 | -5.26 | 470.6 | Leaves and Roots | Methanolic | Kour et al. (2009); Soman et al. (2013); Pandit and Latha (2020) | |
15. | Withanone | 21679027 | -6.14 | 470.6 | Leaves and Roots | Methanolic | Wadegaonkar and Wadegaonkar (2013); Dar et al. (2017); Kumar and Singh (2020); Balkrishna et al. (2020) | |
16. | 27-hydroxy withanolide B | 14236711 | -5.23 | 454.6 | Leaves and Roots | Methanolic | Turrini et al. (2016); Balkrishna et al. (2021) | |
17. | Pseudowithanine | 10955717 | -3.34 | 241.33 | Leaves and Roots | Methanolic | Turrini et al. (2016); Balkrishna et al. (2021) | |
18. | Withasomniferol A | 101710595 | -3.35 | 486.6 | Leaves and Roots | Methanolic | Singh et al. (2020) | |
19. | Withasomniferol B | 101710596 | -4.22 | 472.6 | Leaves and Roots | Methanolic | Singh et al. (2020) | |
20. | Withasomniferol C | 101710597 | -4.88 | 470.6 | Leaves and Roots | Methanolic | Kandagalla et al. (2022) | |
21. | β-sitosterol | 348285530 | -5.44 | 414.71 | Leaves and Roots | Methanolic | Kandagalla et al. (2022) | |
22. | Withanolide | 53477765 | -5.26 | 470.6 | Leaves and Roots | Methanolic | Kalra and Kandimalla (2021) | |
23. | Withanosides II | 101168811 | -11.30 | 798.9 | Leaves and Roots | Methanolic | Kalra and Kandimalla (2021) | |
24. | Withanosides III | 101168810 | 652.8 | Leaves and Roots | Methanolic | Ali et al. (1997); Jayaprakasam et al. (2004); Kalra and Kandimalla (2021) | ||
25. | Withanosides IV | 71312551 | -11.02 | 782.9 | Leaves and Roots | Methanolic | Kalra and Kandimalla (2021) | |
26. | Withanosides V | 10700345 | -8.96 | 766.9 | Leaves and Roots | Methanolic | Kalra and Kandimalla (2021) | |
27. | Withanosides VI | 91827019 | 782.9 | Leaves and Roots | Methanolic | Kalra and Kandimalla (2021) | ||
28. | Physagulin D | 10100412 | -4.48 | 620.8 | Leaves and Roots | Methanolic | Kumar and Singh (2020) | |
29. | Withasomnilide | 102066413 | -4.98 | 470.6 | Stem Bark | Ethanolic | Tong et al. (2011) | |
30. | Somniferanolide | 102066415 | -7.89 | 468.6 | Stem Bark | Methanolic | Hasan et al, 2022; Ali et al, 1997 | |
31. | Somniferine | 14106343 | 9.62 | 608.7 | Stem Bark | Methanolic | Hasan et al, 2022; Ali et al, 1997 | |
32. | Withasomniferanolide | 102066414 | -3.53 | 470.6 | Stem Bark | Methanolic | Kalra and Kandimalla (2021) | |
33. | Somniwithanolide | 102066417 | -5.42 | 486.6 | Stem Bark | Methanolic | Prajapati et al. (2022) | |
34. | Withanolide | 9469353 | -5.81 | 370.4 | Whole plant | Methanolic | Kirson et al. (1971); Kirson et al. (1971); Matsuda et al. (2001); Jayaprakasam and Nair (2003); Choudhary et al. (2010) | |
35. | Viscosalactone B | 57403080 | -11.1 | 488.6 | Whole plant | Methanolic | Borse et al., 2020 | |
36. | 27-acetoxy -4β,6α –dihydroxy -5β-chloro -1-oxowitha -2,24-dienolide | 21044792 | -3.30 | 523.34 | Aerial parts | Methanolic | Kuboyama et al. (2006); Tong et al. (2011); Seth et al. (2020) |