| Entry |
|
|---|
| Name |
Metaproterenol sulfate (USP);
Orciprenaline sulfate (JP18);
Alupent (TN) |
|---|
| Formula |
(C11H17NO3)2. H2SO4
|
|---|
| Exact mass |
520.2091
|
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| Mol weight |
520.5936
|
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| Structure |
|
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| Simcomp |
|
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| Class |
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
|
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| Remark |
|
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| Efficacy |
Bronchodilator, beta2-Adrenergic receptor agonist |
|---|
| Disease |
|
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| Comment |
Phenethylamine derivative
|
|---|
| Target |
|
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| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
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| Interaction |
|
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| Structure map |
| map07214 | beta-Adrenergic receptor agonists/antagonists |
|
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
R RESPIRATORY SYSTEM
R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
R03A ADRENERGICS, INHALANTS
R03AB Non-selective beta-adrenoreceptor agonists
R03AB03 Orciprenaline
D00685 Metaproterenol sulfate (USP)
R03C ADRENERGICS FOR SYSTEMIC USE
R03CB Non-selective beta-adrenoreceptor agonists
R03CB03 Orciprenaline
D00685 Metaproterenol sulfate (USP)
Drug groups [BR:br08330]
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
DG01044 Orciprenaline
D00685 Metaproterenol sulfate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRB2
D00685 Metaproterenol sulfate (USP)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D00685 Orciprenaline sulfate
Drug groups [BR:br08330]
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01452 beta2-Adrenergic receptor agonist
DG01044 Orciprenaline
|
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| Other DBs |
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| KCF data |
ATOM 35
1 C8y C 22.0811 -19.6871
2 C8x C 20.8691 -20.3923
3 C8x C 22.0811 -18.2886
4 C1c C 23.2933 -20.3923
5 C8y C 19.6511 -19.6871
6 C8y C 20.8691 -17.5893
7 C1b C 24.5113 -19.6871
8 O1a O 23.2991 -21.7909
9 C8x C 19.6511 -18.2886
10 O1a O 18.4448 -20.3923
11 O1a O 20.8691 -16.1848
12 N1b N 25.7233 -20.3864
13 C1c C 26.9355 -19.6813
14 C1a C 28.1476 -20.3864
15 C1a C 26.9355 -18.2827
16 S4a S 33.8138 -18.9878
17 O1d O 32.4211 -18.9820
18 O1d O 35.2125 -18.9878
19 O1d O 33.8081 -17.5951
20 O1d O 33.8081 -20.3806
21 C8y C 22.0811 -19.6871
22 C8x C 20.8691 -20.3923
23 C8y C 19.6511 -19.6871
24 C8x C 19.6511 -18.2886
25 C8y C 20.8691 -17.5893
26 C8x C 22.0811 -18.2886
27 O1a O 20.8691 -16.1848
28 O1a O 18.4448 -20.3923
29 C1c C 23.2933 -20.3923
30 C1b C 24.5113 -19.6871
31 N1b N 25.7233 -20.3864
32 C1c C 26.9355 -19.6813
33 C1a C 28.1476 -20.3864
34 C1a C 26.9355 -18.2827
35 O1a O 23.2991 -21.7909
BOND 34
1 16 17 1
2 16 18 1
3 16 19 2
4 16 20 2
5 1 2 2
6 1 3 1
7 1 4 1
8 2 5 1
9 3 6 2
10 4 7 1
11 4 8 1
12 5 9 2
13 5 10 1
14 6 11 1
15 7 12 1
16 12 13 1
17 13 14 1
18 13 15 1
19 6 9 1
20 21 22 2
21 21 26 1
22 21 29 1
23 22 23 1
24 26 25 2
25 29 30 1
26 29 35 1
27 23 24 2
28 23 28 1
29 25 27 1
30 30 31 1
31 31 32 1
32 32 33 1
33 32 34 1
34 25 24 1
BRACKET 1 17.1500 -22.8200 17.1500 -15.1200
1 29.6100 -15.1200 29.6100 -22.8200
1 2
ORIGINAL 1 1 2 5 9 6 3 11 10 4 7 12 13 14 15 8
REPEAT 1 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35
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