Entry |
|
Name |
Isoxsuprine hydrochloride (JP18/USP); Duvadilan (TN) |
Formula |
C18H23NO3. HCl
|
Exact mass |
337.1445
|
Mol weight |
337.8411
|
Structure |
|
Simcomp |
|
Class |
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
|
Remark |
Therapeutic category: | 1249 2172 |
Chemical structure group: | DG00277 |
Product (DG00277): | D01748<JP> |
|
Efficacy |
Vasodilator, beta2-Adrenergic receptor agonist |
Disease |
Arteriosclerosis obliterans [DS:H01626] Thromboangiitis obliterans; Buerger's disease [DS:H01625] Raynaud's disease [DS:H01620] |
Target |
ADRB2 [HSA:154] [KO:K04142] |
Pathway |
hsa04080 | Neuroactive ligand-receptor interaction |
hsa04261 | Adrenergic signaling in cardiomyocytes |
|
Interaction |
|
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
C CARDIOVASCULAR SYSTEM
C04 PERIPHERAL VASODILATORS
C04A PERIPHERAL VASODILATORS
C04AA 2-amino-1-phenylethanol derivatives
C04AA01 Isoxsuprine
D01748 Isoxsuprine hydrochloride (JP18/USP) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
1 Agents affecting nervous system and sensory organs
12 Agents affecting peripheral nervous system
124 Antispasmodics
1249 Others
D01748 Isoxsuprine hydrochloride (JP18/USP)
2 Agents affecting individual organs
21 Cardiovascular agents
217 Vasodilators
2172 Peripheral artery dilators
D01748 Isoxsuprine hydrochloride (JP18/USP)
Drug groups [BR:br08330]
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
DG00277 Isoxsuprine
D01748 Isoxsuprine hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRB2
D01748 Isoxsuprine hydrochloride (JP18/USP) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D01748 Isoxsuprine hydrochloride
D01748 Isoxsuprine hydrochloride tablets
Drug groups [BR:br08330]
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
DG00277 Isoxsuprine
|
Other DBs |
|
KCF data |
ATOM 23
1 C8y C 17.0800 -15.8200
2 C1c C 18.3400 -16.5200
3 C1c C 19.5300 -15.8200
4 N1b N 20.7200 -16.5200
5 C1c C 21.9800 -15.8200
6 C1b C 23.1700 -16.5200
7 O2a O 24.3600 -15.8200
8 C1a C 19.5300 -14.4200
9 C1a C 21.9800 -14.4200
10 C8y C 25.6200 -16.5200
11 C8x C 25.6200 -17.9200
12 C8x C 26.8100 -18.6200
13 C8x C 28.0000 -17.9200
14 C8x C 28.0000 -16.5200
15 C8x C 26.8100 -15.8200
16 O1a O 18.3400 -17.9200
17 C8x C 17.0800 -14.4900
18 C8x C 15.8900 -13.7900
19 C8y C 14.7000 -14.4900
20 C8x C 14.7000 -15.8900
21 C8x C 15.8900 -16.5900
22 O1a O 13.4400 -13.7900
23 X Cl 30.8000 -17.0800
BOND 23
1 5 6 1
2 2 3 1
3 6 7 1
4 10 11 2
5 11 12 1
6 12 13 2
7 13 14 1
8 14 15 2
9 15 10 1
10 2 16 1
11 3 8 1
12 3 4 1
13 5 9 1
14 1 2 1
15 7 10 1
16 1 17 2
17 17 18 1
18 18 19 2
19 19 20 1
20 20 21 2
21 21 1 1
22 4 5 1
23 19 22 1
|