| Entry |
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| Name |
Papaverine sulfate;
Papaverine SAD (TN) |
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| Formula |
(C20H21NO4)2. H2SO4
|
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| Exact mass |
776.2615
|
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| Mol weight |
776.85
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| Structure |
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| Remark |
| Product (DG00043): | D02218<JP> |
|
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| Efficacy |
Antispasmodic, Smooth muscle relaxant, Vasodilator, Phosphodiesterase inhibitor |
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| Comment |
Papaverine derivative
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| Target |
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| Pathway |
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| Interaction |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A03 DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03A DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03AD Papaverine and derivatives
A03AD01 Papaverine
D07439 Papaverine sulfate
G GENITO URINARY SYSTEM AND SEX HORMONES
G04 UROLOGICALS
G04B UROLOGICALS
G04BE Drugs used in erectile dysfunction
G04BE02 Papaverine
D07439 Papaverine sulfate
Target-based classification of drugs [BR:br08310]
Enzymes
Hydrolases (EC3)
Phosphodiesterases
PDE
D07439 Papaverine sulfate
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 55
1 C8y C 16.5900 -16.5200
2 C8y C 16.5900 -15.1900
3 C8y C 17.7800 -17.2200
4 C8x C 15.4000 -17.2200
5 C8x C 15.4000 -14.4900
6 C8x C 17.8500 -14.4900
7 C1b C 17.7800 -18.6200
8 N5x N 19.0400 -16.5200
9 C8y C 14.2100 -16.5200
10 C8y C 14.2100 -15.1900
11 C8x C 19.0400 -15.1900
12 C8y C 19.0400 -19.3200
13 O2a O 12.9500 -17.2200
14 O2a O 12.9500 -14.4900
15 C8x C 20.3000 -18.6200
16 C8x C 19.0400 -20.7200
17 C1a C 11.7600 -16.5200
18 C1a C 11.7600 -15.1900
19 C8y C 21.4900 -19.3200
20 C8x C 20.2300 -21.4200
21 C8y C 21.5600 -20.7200
22 O2a O 22.6800 -18.5500
23 O2a O 22.6800 -21.3500
24 C1a C 23.8700 -19.2500
25 C1a C 23.9400 -20.6500
26 S4a S 31.7800 -18.0600
27 O1d O 31.7800 -16.6600
28 O1d O 31.7800 -19.4600
29 O1d O 33.1800 -18.0600
30 O1d O 30.3800 -18.0600
31 C8y C 16.5900 -16.5200
32 C8y C 16.5900 -15.1900
33 C8x C 15.4000 -14.4900
34 C8y C 14.2100 -15.1900
35 O2a O 12.9500 -14.4900
36 C1a C 11.7600 -15.1900
37 C8y C 14.2100 -16.5200
38 C8x C 15.4000 -17.2200
39 O2a O 12.9500 -17.2200
40 C1a C 11.7600 -16.5200
41 C8x C 17.8500 -14.4900
42 C8x C 19.0400 -15.1900
43 N5x N 19.0400 -16.5200
44 C8y C 17.7800 -17.2200
45 C1b C 17.7800 -18.6200
46 C8y C 19.0400 -19.3200
47 C8x C 20.3000 -18.6200
48 C8y C 21.4900 -19.3200
49 C8y C 21.5600 -20.7200
50 O2a O 22.6800 -21.3500
51 C1a C 23.9400 -20.6500
52 C8x C 20.2300 -21.4200
53 C8x C 19.0400 -20.7200
54 O2a O 22.6800 -18.5500
55 C1a C 23.8700 -19.2500
BOND 58
1 26 27 2
2 26 28 2
3 26 29 1
4 26 30 1
5 1 2 1
6 1 3 1
7 1 4 2
8 2 5 2
9 2 6 1
10 3 7 1
11 3 8 2
12 4 9 1
13 5 10 1
14 6 11 2
15 7 12 1
16 9 13 1
17 10 14 1
18 12 15 1
19 12 16 2
20 13 17 1
21 14 18 1
22 15 19 2
23 16 20 1
24 19 21 1
25 19 22 1
26 21 23 1
27 8 11 1
28 9 10 2
29 20 21 2
30 22 24 1
31 23 25 1
32 31 32 1
33 31 44 1
34 31 38 2
35 32 33 2
36 32 41 1
37 44 45 1
38 44 43 2
39 38 37 1
40 33 34 1
41 41 42 2
42 45 46 1
43 37 39 1
44 34 35 1
45 46 47 1
46 46 53 2
47 39 40 1
48 35 36 1
49 47 48 2
50 53 52 1
51 48 49 1
52 48 54 1
53 49 50 1
54 43 42 1
55 37 34 2
56 52 49 2
57 54 55 1
58 50 51 1
BRACKET 1 9.1000 -22.1900 9.1000 -12.7400
1 26.1800 -12.7400 26.1800 -22.1900
1 2
ORIGINAL 1 1 2 5 10 14 18 9 4 13 17 6 11 8 3 7 12
1 15 19 21 23 25 20 16 22 24
REPEAT 1 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46
1 47 48 49 50 51 52 53 54 55
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