KEGG   DRUG: Dobutamine tartrateHelp
Entry
D03881                      Drug                                   

Name
Dobutamine tartrate (USP)
Formula
C18H23NO3. C4H6O6
Exact mass
451.1842
Mol weight
451.467
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
ATC code: 
Chemical group: 
Activity
Cardiotonic
Target
beta1-adrenergic receptor [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
      D03881  Dobutamine tartrate (USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Dobutamine
      D03881  Dobutamine tartrate (USP)
BRITE hierarchy
Other DBs
CAS: 
101626-66-8
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        32
            1   C8y C    29.0650  -15.7587
            2   C8x C    30.2556  -15.0583
            3   C8x C    29.0650  -17.1593
            4   C1b C    27.8745  -15.0583
            5   C8y C    31.5162  -15.7587
            6   C8x C    30.2556  -17.8596
            7   C1b C    26.6139  -15.7587
            8   C8y C    31.5162  -17.1593
            9   O1a O    32.7067  -15.0583
            10  N1b N    25.4234  -15.0583
            11  O1a O    32.7067  -17.8596
            12  C1c C    24.2328  -15.7587
            13  C1b C    22.9723  -15.0583
            14  C1a C    24.2328  -17.1593
            15  C1b C    21.7817  -15.7587
            16  C8y C    20.5912  -15.0583
            17  C8x C    19.3306  -15.7587
            18  C8x C    20.5912  -13.6577
            19  C8x C    18.1401  -15.0583
            20  C8x C    19.3306  -12.9574
            21  C8y C    18.1401  -13.6577
            22  O1a O    16.9495  -12.9574
            23  C1c C    18.6399  -18.3486
            24  C1c C    19.8304  -19.0489
            25  C6a C    17.3793  -19.0489
            26  O1a O    18.6399  -16.9480
            27  C6a C    21.0210  -18.3486
            28  O1a O    19.8304  -20.4496
            29  O6a O    16.1888  -18.3486
            30  O6a O    17.3793  -20.4496
            31  O6a O    22.2115  -19.0489
            32  O6a O    21.0210  -16.9480
BOND        32
            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
            24   23  24 1
            25   23  25 1
            26   23  26 1 #Up
            27   24  27 1
            28   24  28 1 #Up
            29   25  29 1
            30   25  30 2
            31   27  31 1
            32   27  32 2

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