| Entry |
|
|---|
| Name |
Isoetharine mesylate (USP);
Bronkometer (TN) |
|---|
| Formula |
C13H21NO3. CH4SO3
|
|---|
| Exact mass |
335.1403
|
|---|
| Mol weight |
335.42
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
DG01951 Catecholamine adrenergic receptor agonist
|
|---|
| Remark |
|
|---|
| Efficacy |
Bronchodilator, beta2-Adrenergic receptor agonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
R RESPIRATORY SYSTEM
R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
R03A ADRENERGICS, INHALANTS
R03AC Selective beta-2-adrenoreceptor agonists
R03AC07 Isoetarine
D04626 Isoetharine mesylate (USP)
Drug groups [BR:br08330]
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
DG01234 Isoetharine
D04626 Isoetharine mesylate
DG01951 Catecholamine adrenergic receptor agonist
DG01234 Isoetharine
D04626 Isoetharine mesylate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRB2
D04626 Isoetharine mesylate (USP)
Drug groups [BR:br08330]
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
DG01234 Isoetharine
DG01951 Catecholamine adrenergic receptor agonist
DG01234 Isoetharine
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 22
1 C8y C 13.8600 -15.4700
2 C1c C 15.1200 -14.7700
3 C8x C 13.8600 -16.8700
4 C8x C 12.6700 -14.7700
5 C1c C 16.3100 -15.4700
6 O1a O 15.1200 -13.3700
7 C8x C 12.6700 -17.5700
8 C8y C 11.4800 -15.4700
9 N1b N 17.5000 -14.7700
10 C1b C 16.3100 -16.8700
11 C8y C 11.4800 -16.8700
12 C1c C 18.7600 -15.4700
13 O1a O 10.2200 -17.5700
14 C1a C 19.9500 -14.7700
15 C1a C 18.7600 -16.8700
16 C1a C 17.5000 -17.5700
17 O1a O 10.2647 -14.7749
18 O1d O 25.6900 -15.1200
19 S4a S 25.6900 -16.5200
20 C1a C 24.2900 -16.5200
21 O1d O 27.0900 -16.5200
22 O1d O 25.6900 -17.8500
BOND 21
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1
6 3 7 2
7 4 8 1
8 5 9 1
9 5 10 1
10 7 11 1
11 9 12 1
12 11 13 1
13 12 14 1
14 12 15 1
15 8 11 2
16 10 16 1
17 8 17 1
18 18 19 2
19 19 20 1
20 19 21 1
21 19 22 2
|
|---|
