| Entry |
|
|---|
| Name |
Bethanidine sulfate (JAN/USAN);
Tenathan (TN) |
|---|
| Formula |
(C10H16N3)2. SO4
|
|---|
| Exact mass |
452.2206
|
|---|
| Mol weight |
452.5709
|
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| Structure |
|
|---|
| Class |
Cardiovascular agent
DG01739 Peripherally-acting antiadrenergic
|
|---|
| Remark |
|
|---|
| Efficacy |
Antihypertensive |
|---|
| Comment |
Guanidine derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
C CARDIOVASCULAR SYSTEM
C02 ANTIHYPERTENSIVES
C02C ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
C02CC Guanidine derivatives
C02CC01 Betanidine
D01603 Bethanidine sulfate (JAN/USAN)
Drug groups [BR:br08330]
Cardiovascular agent
DG01739 Peripherally-acting antiadrenergic
D01603 Bethanidine sulfate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRA2
D01603 Bethanidine sulfate (JAN/USAN)
Ion channels
Voltage-gated ion channels
Inward rectifier channels (Kir)
KCNJ1
D01603 Bethanidine sulfate (JAN/USAN)
|
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| Other DBs |
|
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| LinkDB |
|
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| KCF data |
ATOM 31
1 C8x C 15.8015 -17.8197
2 C8x C 15.8015 -19.2199
3 C8x C 17.0170 -19.9200
4 C8x C 18.2254 -19.2199
5 C8y C 18.2254 -17.8197
6 C8x C 17.0170 -17.1196
7 C1b C 19.4384 -17.1206
8 N2b N 19.4396 -15.7205
9 C2c C 20.6526 -15.0212
10 N1b N 20.6538 -13.6210 #+
11 N1b N 21.8647 -15.7222
12 C1a C 23.0779 -15.0229
13 C1a C 19.4517 -12.9260
14 O1d O 26.3956 -15.6926 #-
15 S4a S 27.7955 -15.6926
16 O1d O 27.7884 -14.2926
17 O1d O 29.1955 -15.6926 #-
18 O1d O 27.7884 -17.0926
19 C8x C 15.8015 -17.8197
20 C8x C 15.8015 -19.2199
21 C8x C 17.0170 -19.9200
22 C8x C 18.2254 -19.2199
23 C8y C 18.2254 -17.8197
24 C1b C 19.4384 -17.1206
25 N2b N 19.4396 -15.7205
26 C2c C 20.6526 -15.0212
27 N1b N 20.6538 -13.6210 #+
28 C1a C 19.4517 -12.9260
29 N1b N 21.8647 -15.7222
30 C1a C 23.0779 -15.0229
31 C8x C 17.0170 -17.1196
BOND 30
1 14 15 1
2 15 16 2
3 15 17 1
4 15 18 2
5 5 7 1
6 7 8 1
7 8 9 2
8 1 2 2
9 9 10 1
10 2 3 1
11 3 4 2
12 9 11 1
13 4 5 1
14 5 6 2
15 6 1 1
16 11 12 1
17 10 13 1
18 23 24 1
19 24 25 1
20 25 26 2
21 19 20 2
22 26 27 1
23 20 21 1
24 21 22 2
25 26 29 1
26 22 23 1
27 23 31 2
28 31 19 1
29 29 30 1
30 27 28 1
BRACKET 1 15.4700 -20.0900 15.4700 -12.2500
1 24.9200 -12.2500 24.9200 -20.0900
1 2
ORIGINAL 1 1 2 3 4 5 7 8 9 10 13 11 12 6
REPEAT 1 19 20 21 22 23 24 25 26 27 28 29 30 31
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