KEGG   DRUG: DobutamineHelp
Entry
D03879                      Drug                                   

Name
Dobutamine (USP/INN)
Formula
C18H23NO3
Exact mass
301.1678
Mol weight
301.3801
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Cardiovascular agent
 DG01703  Cardiotonic
  DG01699  Catecholamine cardiotonic
 DG01456  Adrenergic receptor agonist
  DG01455  beta-Adrenergic receptor agonist
   DG01451  beta1-Adrenergic receptor agonist
Remark
Same as: 
ATC code: 
Chemical group: 
Activity
Cardiotonic, beta1-Adrenergic receptor agonist
Comment
Catecholamine derivative
Target
ADRB1 [HSA:153] [KO:K04141]
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Adrenergic signaling in cardiomyocytes
Salivary secretion
Interaction
Drug interaction
Structure map
beta-Adrenergic receptor agonists/antagonists
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 (USP/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Dobutamine
      D03879  Dobutamine (USP/INN)
BRITE hierarchy
Other DBs
CAS: 
34368-04-2
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

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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