Entry |
|
Name |
Inarigivir soproxil (USAN) |
Formula |
C25H34N7O13PS
|
Exact mass |
703.1673
|
Mol weight |
703.62
|
Structure |

|
Efficacy |
Antiviral |
Comment |
Treatment of viral infections
|
Target |
|
Pathway |
hsa04621 | NOD-like receptor signaling pathway |
|
Brite |
Target-based classification of drugs [BR:br08310]
Cytokines and receptors
Pattern recognition receptors
NOD-like receptors
NOD2
D11385 Inarigivir soproxil (USAN)
Enzymes
Hydrolases (EC3)
Carboxylic-ester hydrolases
RARRES3 (DDX58, RIG1)
D11385 Inarigivir soproxil (USAN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 47
1 C1y C 14.9800 -15.8200
2 O2b O 16.1924 -16.5200
3 P1b P 17.3879 -15.8296
4 O2b O 18.5753 -16.5151
5 C1b C 19.7665 -15.8271
6 C1y C 20.9560 -16.5138
7 S2a S 17.3880 -14.4203
8 O3b O 16.1504 -15.1150
9 C1b C 18.5794 -13.7322
10 O7a O 19.7645 -14.4164
11 C7a C 20.9569 -13.7277
12 C1y C 21.3709 -17.8488
13 C1x C 22.7740 -17.8666
14 C1y C 23.2245 -16.5377
15 O2x O 22.0999 -15.6986
16 O1a O 20.5257 -18.9816
17 N4y N 24.5805 -16.1164
18 C8x C 25.6879 -16.9428
19 N5x N 26.8161 -16.1450
20 C8y C 26.4060 -14.8255
21 C8y C 25.0243 -14.8078
22 C8y C 27.1214 -13.6221
23 N5x N 26.4370 -12.4008
24 C8x C 25.0554 -12.3831
25 N5x N 24.3399 -13.5865
26 N1a N 28.4900 -13.6402
27 O6a O 22.1458 -14.4141
28 O7a O 20.9569 -12.3203
29 C1c C 22.1491 -11.6317
30 C1a C 23.3347 -12.3161
31 C1a C 22.1492 -10.2203
32 C1y C 14.5705 -14.4812
33 C1y C 13.1707 -14.4570
34 O2x O 12.7151 -15.7808
35 C1y C 13.8333 -16.6232
36 C1b C 13.8803 -17.9891
37 O1a O 15.1005 -18.6389
38 O2a O 15.4048 -13.3736
39 C1a C 16.7892 -13.4034
40 N4y N 12.3771 -13.3269
41 C8x C 13.0844 -12.0843
42 C8x C 12.3769 -10.8762
43 C8y C 10.9769 -10.8848
44 N4x N 10.2697 -12.1274
45 C8y C 10.9771 -13.2655
46 O5x O 10.2583 -14.4936
47 O5x O 10.2574 -9.6570
BOND 51
1 1 2 1 #Down
2 2 3 1
3 3 4 1
4 4 5 1
5 6 5 1 #Up
6 3 7 1
7 3 8 2
8 7 9 1
9 9 10 1
10 10 11 1
11 6 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 6 15 1
16 12 16 1 #Down
17 14 17 1 #Up
18 17 18 1
19 18 19 2
20 19 20 1
21 20 21 1
22 17 21 1
23 20 22 2
24 22 23 1
25 23 24 2
26 24 25 1
27 21 25 2
28 22 26 1
29 11 27 2
30 11 28 1
31 28 29 1
32 29 30 1
33 29 31 1
34 1 32 1
35 32 33 1
36 33 34 1
37 34 35 1
38 1 35 1
39 35 36 1 #Up
40 36 37 1
41 32 38 1 #Down
42 38 39 1
43 33 40 1 #Up
44 40 41 1
45 41 42 2
46 42 43 1
47 43 44 1
48 44 45 1
49 40 45 1
50 45 46 2
51 43 47 2
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