| Entry |
|
|---|
| Name |
Dobutamine (USAN/INN) |
|---|
| Formula |
C18H23NO3
|
|---|
| Exact mass |
301.1678
|
|---|
| Mol weight |
301.3801
|
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| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Cardiovascular agent
DG01703 Cardiotonic
DG01699 Catecholamine cardiotonic
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01451 beta1-Adrenergic receptor agonist
DG01951 Catecholamine adrenergic receptor agonist
|
|---|
| Remark |
| Product (DG00216): | D00632<JP/US> |
|
|---|
| Efficacy |
Cardiotonic, beta1-Adrenergic receptor agonist |
|---|
| Comment |
Catecholamine derivative
|
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| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
| hsa04261 | Adrenergic signaling in cardiomyocytes |
|
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| Interaction |
|
|---|
| Structure map |
| map07214 | beta-Adrenergic receptor agonists/antagonists |
|
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
C CARDIOVASCULAR SYSTEM
C01 CARDIAC THERAPY
C01C CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
C01CA Adrenergic and dopaminergic agents
C01CA07 Dobutamine
D03879 Dobutamine (USAN/INN)
Drug groups [BR:br08330]
Cardiovascular agent
DG01703 Cardiotonic
DG01699 Catecholamine cardiotonic
DG00216 Dobutamine
D03879 Dobutamine
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01451 beta1-Adrenergic receptor agonist
DG00216 Dobutamine
D03879 Dobutamine
DG01951 Catecholamine adrenergic receptor agonist
DG00216 Dobutamine
D03879 Dobutamine
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRB1
D03879 Dobutamine (USAN/INN)
Drug groups [BR:br08330]
Cardiovascular agent
DG01703 Cardiotonic
DG01699 Catecholamine cardiotonic
DG00216 Dobutamine
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01451 beta1-Adrenergic receptor agonist
DG00216 Dobutamine
DG01951 Catecholamine adrenergic receptor agonist
DG00216 Dobutamine
|
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| Other DBs |
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| KCF data |
ATOM 22
1 C8y C 14.4200 -16.4500
2 C8x C 13.2300 -15.8200
3 C8x C 14.4200 -17.8500
4 C1b C 15.6100 -15.8200
5 C8y C 12.0400 -16.5200
6 C8x C 13.2300 -18.6200
7 C1b C 16.8700 -16.4500
8 C8y C 12.0400 -17.9200
9 O1a O 10.7800 -15.8200
10 N1b N 18.0600 -15.8200
11 O1a O 10.7100 -18.6200
12 C1c C 19.2500 -16.5200
13 C1b C 20.5100 -15.8200
14 C1a C 19.2500 -17.8500
15 C1b C 21.7000 -16.5200
16 C8y C 22.8900 -15.8200
17 C8x C 24.0800 -16.5200
18 C8x C 22.8900 -14.4200
19 C8x C 25.3400 -15.8200
20 C8x C 24.0800 -13.7200
21 C8y C 25.3400 -14.4200
22 O1a O 26.5300 -13.7200
BOND 23
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 3 6 2
6 4 7 1
7 5 8 2
8 5 9 1
9 7 10 1
10 8 11 1
11 10 12 1
12 12 13 1
13 12 14 1
14 13 15 1
15 15 16 1
16 16 17 2
17 16 18 1
18 17 19 1
19 18 20 2
20 19 21 2
21 21 22 1
22 6 8 1
23 20 21 1
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