| Entry |
|
|---|
| Name |
Guanadrel sulfate (USAN);
Hylorel (TN) |
|---|
| Formula |
(C10H19N3O2)2. H2SO4
|
|---|
| Exact mass |
524.2628
|
|---|
| Mol weight |
524.632
|
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| Structure |
|
|---|
| Class |
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01450 alpha-Adrenergic receptor agonist
|
|---|
| Efficacy |
Antihypertensive, alpha-Adrenergic receptor agonist |
|---|
| Comment |
Guanidine derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
| hsa04270 | Vascular smooth muscle contraction |
|
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| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01450 alpha-Adrenergic receptor agonist
D00607 Guanadrel sulfate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRA1
D00607 Guanadrel sulfate (USAN)
ADRA2
D00607 Guanadrel sulfate (USAN)
|
|---|
| Other DBs |
|
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| KCF data |
ATOM 35
1 C1y C 31.3600 -15.5400
2 C1b C 30.1000 -16.2400
3 N1b N 28.9100 -15.4000
4 C2c C 27.5100 -16.1700
5 N1a N 26.2500 -15.3300
6 N2a N 27.5100 -17.7100
7 C1x C 31.3600 -14.1400
8 O2x O 32.6900 -15.9600
9 C1z C 33.5300 -14.8400
10 O2x O 32.6900 -13.7200
11 C1x C 34.2300 -16.0300
12 C1x C 35.6300 -16.0300
13 C1x C 36.3300 -14.8400
14 C1x C 35.6300 -13.5800
15 C1x C 34.2300 -13.5800
16 S4a S 40.0820 -15.5800
17 O1d O 40.0820 -14.1800
18 O1d O 40.0820 -16.9800
19 O1d O 38.6819 -15.5800
20 O1d O 41.4819 -15.5800
21 C1y C 31.3600 -15.5400
22 C1b C 30.1000 -16.2400
23 N1b N 28.9100 -15.4000
24 C2c C 27.5100 -16.1700
25 N1a N 26.2500 -15.3300
26 N2a N 27.5100 -17.7100
27 C1x C 31.3600 -14.1400
28 O2x O 32.6900 -13.7200
29 C1z C 33.5300 -14.8400
30 O2x O 32.6900 -15.9600
31 C1x C 34.2300 -16.0300
32 C1x C 35.6300 -16.0300
33 C1x C 36.3300 -14.8400
34 C1x C 35.6300 -13.5800
35 C1x C 34.2300 -13.5800
BOND 36
1 16 17 2
2 16 18 2
3 16 19 1
4 16 20 1
5 1 2 1
6 2 3 1
7 3 4 1
8 4 5 1
9 4 6 2
10 1 7 1
11 1 8 1
12 8 9 1
13 9 10 1
14 7 10 1
15 9 11 1
16 11 12 1
17 12 13 1
18 13 14 1
19 14 15 1
20 9 15 1
21 21 22 1
22 22 23 1
23 23 24 1
24 24 25 1
25 24 26 2
26 21 27 1
27 21 30 1
28 30 29 1
29 29 28 1
30 27 28 1
31 29 31 1
32 31 32 1
33 32 33 1
34 33 34 1
35 34 35 1
36 29 35 1
BRACKET 1 24.5700 -18.4800 24.5700 -13.0900
1 36.7500 -13.0900 36.7500 -18.4800
1 2
ORIGINAL 1 1 2 3 4 5 6 7 10 9 8 11 12 13 14 15
REPEAT 1 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35
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