KEGG   DRUG: D03881Help
Entry
D03881                      Drug                                   
Name
Dobutamine tartrate (USP)
Formula
C18H23NO3. C4H6O6
Exact mass
451.1842
Mol weight
451.467
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Cardiotonic
Remark
ATC code: 
Target
beta1-adrenergic receptor agonist [HSA:153] [KO:K04141]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04970  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 [HSA:153] [KO:K04141]
     Dobutamine [ATC:C01CA07]
      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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