| Entry |
|
|---|
| Name |
Cinaciguat (JAN/INN) |
|---|
| Formula |
C36H39NO5
|
|---|
| Exact mass |
565.2828
|
|---|
| Mol weight |
565.6986
|
|---|
| Structure |
|
|---|
| Class |
Cardiovascular agent
DG03006 Guanylate cyclase activator
|
|---|
| Efficacy |
Vasodilator, Guanylate cyclase activator |
|---|
| Target |
|
|---|
| Pathway |
| hsa04270 | Vascular smooth muscle contraction |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Cardiovascular agent
DG03006 Guanylate cyclase activator
D07577 Cinaciguat
Target-based classification of drugs [BR:br08310]
Enzymes
Lyases (EC4)
Phosphorus-oxygen lyases
GUCY1A
D07577 Cinaciguat (JAN/INN)
GUCY1B
D07577 Cinaciguat (JAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 42
1 C8x C 7.1400 -18.8300
2 C8x C 7.1400 -20.2300
3 C8x C 8.3524 -20.9300
4 C8x C 9.5649 -20.2300
5 C8y C 9.5649 -18.8300
6 C8x C 8.3524 -18.1300
7 C1b C 10.7960 -18.1190
8 C1b C 12.0012 -18.8147
9 C8y C 13.1835 -18.1319
10 C8x C 14.3775 -18.8212
11 C8x C 15.5899 -18.1212
12 C8y C 15.5899 -16.7212
13 C8x C 14.3960 -16.0319
14 C8x C 13.1835 -16.7319
15 C1b C 16.8134 -16.0146
16 O2a O 18.0224 -16.7125
17 C8y C 19.2029 -16.0308
18 C8y C 20.3978 -16.7207
19 C8x C 21.6102 -16.0207
20 C8x C 21.6102 -14.6207
21 C8x C 20.4154 -13.9308
22 C8x C 19.2029 -14.6308
23 C1b C 20.3979 -18.1297
24 C1b C 21.5894 -18.8178
25 N1c N 22.7745 -18.1336
26 C1b C 23.9669 -18.8222
27 C1b C 22.7746 -16.7302
28 C8y C 23.9686 -16.0408
29 C8x C 25.1549 -16.7258
30 C8x C 26.3673 -16.0258
31 C8y C 26.3674 -14.6258
32 C8x C 25.1811 -13.9409
33 C8x C 23.9687 -14.6408
34 C1b C 25.1558 -18.1358
35 C1b C 26.3463 -18.8233
36 C1b C 27.5361 -18.1364
37 C6a C 28.7261 -18.8236
38 O6a O 29.9162 -18.1366
39 O6a O 28.7261 -20.2298
40 C6a C 27.5948 -13.9170
41 O6a O 28.8017 -14.6137
42 O6a O 27.5946 -12.5301
BOND 45
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 5 7 1
8 7 8 1
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 9 14 1
16 12 15 1
17 15 16 1
18 16 17 1
19 17 18 2
20 18 19 1
21 19 20 2
22 20 21 1
23 21 22 2
24 17 22 1
25 18 23 1
26 23 24 1
27 24 25 1
28 25 26 1
29 25 27 1
30 27 28 1
31 28 29 2
32 29 30 1
33 30 31 2
34 31 32 1
35 32 33 2
36 28 33 1
37 26 34 1
38 34 35 1
39 35 36 1
40 36 37 1
41 37 38 1
42 37 39 2
43 31 40 1
44 40 41 1
45 40 42 2
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