From: Cheminformatics studies to analyze the therapeutic potential of phytochemicals from Rhazya stricta
ID | Name | CR | NR | NOR | HetR | #R | Para | Ind.Ref | Sur.Ten | Density | Polar. |
---|---|---|---|---|---|---|---|---|---|---|---|
1 | Akuammidine | 0.81 | 0.08 | 0.19 | 0.19 | 6 | 743.43 | 1.68 | 65.34 | 1.35 | 39.32 |
2 | Antirhine | 0.86 | 0.09 | 0.14 | 0.14 | 4 | 676.25 | 1.65 | 56.53 | 1.2 | 35.76 |
3 | 3-Epi-antirhine | 0.86 | 0.09 | 0.14 | 0.14 | 4 | 676.25 | 1.65 | 56.53 | 1.2 | 35.76 |
4 | Aspidosespermidine | 0.9 | 0.1 | 0.1 | 0.1 | 5 | 647.87 | 1.63 | 50.04 | 1.16 | 34.2 |
5 | Condylocarpine | 0.83 | 0.08 | 0.17 | 0.17 | 5 | 681.18 | 1.66 | 56.36 | 1.3 | 36.43 |
6 | Dihydrocorynantheol | 0.86 | 0.09 | 0.14 | 0.14 | 4 | 687.1 | 1.64 | 55.86 | 1.19 | 35.85 |
7 | Eburnamenine | 0.9 | 0.1 | 0.1 | 0.1 | 5 | 589.57 | 1.7 | 49.78 | 1.25 | 33.94 |
8 | Eburnamine | 0.86 | 0.09 | 0.14 | 0.14 | 5 | 595.24 | 1.72 | 54.34 | 1.35 | 34.28 |
9 | Eburnamonine | 0.86 | 0.09 | 0.14 | 0.14 | 5 | 595.24 | 1.72 | 54.34 | 1.34 | 34.28 |
10 | Geissoschizine | 0.81 | 0.08 | 0.19 | 0.19 | 4 | 762.54 | 1.66 | 61.38 | 1.29 | 40.01 |
11 | Isositsirikine | 0.81 | 0.08 | 0.19 | 0.19 | 4 | 776.63 | 1.64 | 59.3 | 1.27 | 40.13 |
12 | 16-Epi-Z-isositsirikine | 0.81 | 0.08 | 0.19 | 0.19 | 4 | 776.63 | 1.64 | 59.3 | 1.27 | 40.13 |
13 | Leuconolam | 0.79 | 0.08 | 0.21 | 0.21 | 4 | 692.66 | 1.65 | 63.34 | 1.33 | 35.61 |
14 | Rhazinilam | 0.86 | 0.09 | 0.14 | 0.14 | 4 | 635.67 | 1.65 | 47.86 | 1.22 | 34.93 |
15 | Tetrahydrosecamine | 0.84 | 0.08 | 0.16 | 0.16 | 7 | 1449.04 | 1.63 | 46.81 | 1.23 | 78.28 |
16 | Presecamine | 0.84 | 0.08 | 0.16 | 0.16 | 7 | 1516.34 | 1.65 | 60.13 | 1.24 | 78.73 |
17 | Sewarine | 0.8 | 0.08 | 0.2 | 0.2 | 5 | 696.4 | 1.69 | 64.76 | 1.38 | 37.04 |
18 | Stemmadenine | 0.81 | 0.08 | 0.19 | 0.19 | 5 | 729.69 | 1.64 | 47.88 | 1.28 | 39.55 |
19 | Strictamine | 0.83 | 0.08 | 0.17 | 0.17 | 5 | 631.14 | 1.71 | 52.17 | 1.37 | 36.23 |
20 | Strictosamide | 0.72 | 0.06 | 0.28 | 0.28 | 6 | 986.67 | 1.72 | 84.28 | 1.53 | 50.75 |
21 | Strictosidine | 0.71 | 0.05 | 0.29 | 0.29 | 5 | 1078.5 | 1.66 | 74.07 | 1.44 | 54 |
22 | Tabersonine | 0.84 | 0.08 | 0.16 | 0.16 | 5 | 723.31 | 1.65 | 55.72 | 1.27 | 38.37 |
23 | Tetrahydroalstonine | 0.81 | 0.08 | 0.19 | 0.19 | 5 | 748.43 | 1.66 | 58.69 | 1.3 | 39.39 |
24 | Vallesiachotamine | 0.81 | 0.08 | 0.19 | 0.19 | 4 | 754.43 | 1.65 | 59.07 | 1.29 | 39.54 |
25 | Aspidospermiose | 0.77 | 0.06 | 0.23 | 0.23 | 6 | 885.22 | 1.68 | 74 | 1.42 | 45.19 |
26 | Bhimberine | 0.81 | 0.08 | 0.19 | 0.19 | 4 | 776.63 | 1.64 | 59.3 | 1.27 | 40.13 |
27 | Bhimbhrine N-oxide | 0.78 | 0.07 | 0.22 | 0.22 | 4 | Â | Â | Â | Â | Â 45.12 |
28 | Rhazimine | 0.81 | 0.08 | 0.19 | 0.19 | 6 | 690.3 | 1.69 | 54.96 | 1.38 | 38.6 |
29 | Rhazimanine | 0.81 | 0.08 | 0.19 | 0.19 | 4 | 776.63 | 1.64 | 59.3 | 1.27 | 40.13 |
30 | Rhazicine | 0.78 | 0.07 | 0.22 | 0.22 | 6 | 757.54 | 1.66 | 64.83 | 1.38 | 39.13 |
31 | Leepacine | 0.81 | 0.08 | 0.19 | 0.19 | 7 | 709 | 1.68 | 63.18 | 1.39 | 37.7 |
32 | 2-Methoxy-1,2-dihydrorhazimine | 0.79 | 0.07 | 0.21 | 0.21 | 6 | 800.93 | 1.63 | 56.72 | 1.31 | 41.05 |
33 | HR-1 | 0.78 | 0.07 | 0.22 | 0.22 | 4 | Â | Â | Â | Â | Â |
34 | Vincanicine | 0.83 | 0.08 | 0.17 | 0.17 | 5 | 683.12 | 1.66 | 57.29 | 1.3 | 36.52 |
35 | Rhazinaline | 0.81 | 0.08 | 0.19 | 0.19 | 5 | 690.3 | 1.69 | 54.96 | 1.38 | 38.6 |
36 | Beta-sitosterol | 0.97 | 0 | 0.03 | 0.03 | 4 | 1051.02 | 1.52 | 37.64 | 0.98 | 51.22 |
37 | Ursolic acid | 0.91 | 0 | 0.09 | 0.09 | 5 | 1076.71 | 1.56 | 45 | 1.1 | 52.93 |
38 | Stigmasterol | 0.97 | 0 | 0.03 | 0.03 | 4 | 1038.63 | 1.53 | 38.25 | 0.99 | 51.19 |
39 | Oleanolic acid | 0.91 | 0 | 0.09 | 0.09 | 5 | 1077.07 | 1.56 | 45.41 | 1.1 | 52.95 |
40 | Rhazidigenine | 0.86 | 0.09 | 0.14 | 0.14 | 4 | 650.55 | 1.64 | 48.09 | 1.21 | 35.15 |
41 | N-methylleuconolam | 0.8 | 0.08 | 0.2 | 0.2 | 4 | 730.79 | 1.65 | 61.9 | 1.31 | 37.53 |
42 | (+)-Quebrachamine | 0.9 | 0.1 | 0.1 | 0.1 | 4 | 672.49 | 1.62 | 50.29 | 1.12 | 35.27 |
43 | Polyneuridine | 0.81 | 0.08 | 0.19 | 0.19 | 6 | 735.31 | 1.67 | 62.83 | 1.34 | 38.85 |
44 | (+)-Vincadiformine | 0.84 | 0.08 | 0.16 | 0.16 | 5 | 735.7 | 1.63 | 53.98 | 1.25 | 38.4 |
45 | (-)-Vincadifformine | 0.84 | 0.08 | 0.16 | 0.16 | 5 | 735.7 | 1.63 | 53.98 | 1.25 | 38.4 |
46 | Secamine | 0.84 | 0.08 | 0.16 | 0.16 | 7 | 1449.04 | 1.63 | 46.81 | 1.22 | 78.28 |
47 | Vincadine | 0.84 | 0.08 | 0.16 | 0.16 | 4 | 776.11 | 1.61 | 52.34 | 1.18 | 39.67 |
48 | Bis-strictidine | 0.9 | 0.1 | 0.1 | 0.1 | 9 | 1150.88 | 1.73 | 52.95 | 1.31 | 67.18 |
49 | 3,14-Dehydrorhazigine | 0.87 | 0.09 | 0.13 | 0.13 | 7 | 1340.13 | 1.64 | 46.53 | 1.2 | 73.46 |
50 | 16-Hydrorhazisidine | 0.85 | 0.09 | 0.15 | 0.15 | 7 | 1345.28 | 1.65 | 48.02 | 1.24 | 73.94 |
51 | Rhazisidine | 0.87 | 0.09 | 0.13 | 0.13 | 8 | 1284.82 | 1.68 | 49.12 | 1.27 | 72.59 |
52 | Isorhazicine | 0.78 | 0.07 | 0.22 | 0.22 | 6 | 757.54 | 1.66 | 64.83 | 1.38 | 39.13 |
53 | Rhazigine | 0.87 | 0.09 | 0.13 | 0.13 | 7 | 1412.62 | 1.65 | 58.36 | 1.21 | 74.23 |
54 | Strictisidine | 0.81 | 0.08 | 0.19 | 0.19 | 7 | 635.5 | 1.78 | 63.63 | 1.55 | 37.59 |
55 | Strictamine-N-oxide | 0.8 | 0.08 | 0.2 | 0.2 | 5 | Â | Â | Â | Â | Â |
56 | Strictigine | 0.9 | 0.1 | 0.1 | 0.1 | 5 | 622.49 | 1.63 | 42.69 | 1.14 | 34.52 |
57 | Strictine | 0.8 | 0.08 | 0.2 | 0.2 | 5 | 636.29 | 1.73 | 55.79 | 1.44 | 36.71 |
58 | Stricticine | 0.8 | 0.08 | 0.2 | 0.2 | 6 | 682.41 | 1.68 | 61.46 | 1.39 | 36.43 |
59 | Strictalamine | 0.86 | 0.09 | 0.14 | 0.14 | 5 | 580.88 | 1.74 | 55.15 | 1.37 | 33.92 |
60 | 1,2-Dehydroaspidospermidine | 0.9 | 0.1 | 0.1 | 0.1 | 5 | 590.09 | 1.7 | 50.6 | 1.27 | 33.8 |
61 | Tetrahydrosecodine | 0.84 | 0.08 | 0.16 | 0.16 | 3 | 807.26 | 1.56 | 42.67 | 1.08 | 40.69 |
62 | Dihydrosecodine | 0.84 | 0.08 | 0.16 | 0.16 | 3 | 793.18 | 1.58 | 44.47 | 1.11 | 40.53 |
63 | Dihydrosecamine | 0.84 | 0.08 | 0.16 | 0.16 | 7 | 1449.04 | 1.63 | 46.81 | 1.23 | 78.28 |
64 | Dihydropresecamine | 0.84 | 0.08 | 0.16 | 0.16 | 7 | 1530.43 | 1.64 | 59.1 | 1.23 | 78.84 |
65 | Tetrahydropresecamine | 0.84 | 0.08 | 0.16 | 0.16 | 7 | 1544.52 | 1.63 | 58.11 | 1.22 | 78.96 |
66 | Rhazinol | 0.86 | 0.09 | 0.14 | 0.14 | 5 | 580.88 | 1.74 | 55.15 | 1.38 | 33.92 |
67 | Rhazimol | 0.81 | 0.08 | 0.19 | 0.19 | 5 | 690.3 | 1.69 | 54.96 | 1.39 | 38.6 |
68 | Rhazidigenine-N-oxide | 0.83 | 0.09 | 0.17 | 0.17 | 4 | Â | Â | Â | Â | Â |
69 | (-)16R,21R-omethyleburnamine | 0.87 | 0.09 | 0.13 | 0.13 | 5 | 639.83 | 1.67 | 47.55 | 1.27 | 36.25 |
70 | Decarbomethoxy-15,20,16,17-tetrahydros | 0.9 | 0.1 | 0.1 | 0.1 | 3 | 703.65 | 1.57 | 40.68 | 1.02 | 36.31 |
71 | 1-2-Dehydroasidospermidine-N-oxide | 0.86 | 0.09 | 0.14 | 0.14 | 5 | Â | Â | Â | Â | Â |
72 | Rhazizine | 0.78 | 0.07 | 0.22 | 0.22 | 6 | 744.62 | 1.67 | 62.43 | 1.39 | 39.14 |
73 | 15-Hydroxyvincadifformine | 0.81 | 0.08 | 0.19 | 0.19 | 5 | 750.68 | 1.65 | 60.33 | 1.32 | 39 |
74 | Dihydroeburnamenine | 0.9 | 0.1 | 0.1 | 0.1 | 5 | 589.57 | 1.7 | 49.78 | 1.26 | 33.94 |
75 | 16s,16′-Decarboxytetra-hydrosecamine | 0.87 | 0.09 | 0.13 | 0.13 | 7 | 1339.61 | 1.64 | 46.2 | 1.21 | 73.6 |
76 | Nor-C-fluorocurarine | 0.86 | 0.09 | 0.14 | 0.14 | 5 | 624.5 | 1.68 | 57.83 | 1.29 | 33.99 |
77 | Strictibine | 0.81 | 0.06 | 0.19 | 0.19 | 3 | 442.8 | 1.65 | 51.74 | 1.29 | 23.76 |