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. 2023 May 22;18(5):295–308. doi: 10.2217/fvl-2022-0163

Table 2. . Binding energies of abietane, jatrophane, segetane, pepluane, paraliane derivatives and GC373.

No. Lowest energy of docking (kcal/mol)
1 -6.24 ± 0.36
2 -6.4 ± 0.47
3 -6.20 ± 0.29
4 -6.23 ± 0.50
5 -6.63 ± 0.38
6 -5.42 ± 0.33
7 -5.48 ± 0.24
8 -6.00 ± 0.28
9 -5.90 ± 0.45
10 -5.27 ± 0.41
11 -5.52 ± 0.23
12 -5.53 ± 0.26
13 -6.72 ± 0.22
14 -6.59 ± 0.39
15 -5.78 ± 0.32
16 -6.00 ± 0.47
17§ -5.39 ± 0.21
18§ -6.36 ± 0.41
19§ -6.33 ± 0.34
20§ -6.02 ± 0.41
21§ -6.73 ± 0.47
22 -6.58 ± 0.50
23# -6.26 ± 0.65
24# -6.71 ± 0.63
Standard -6.52 ± 0.30

Abietane

Jatrophane

§

Segetane

Pepluane

#

Paraliane