KEGG   DRUG: Ibopamine hydrochlorideHelp
Entry
D08057                      Drug                                   

Name
Ibopamine hydrochloride;
Scandine (TN)
Formula
C17H25NO4. HCl
Exact mass
343.155
Mol weight
343.8456
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01703  Cardiotonic
  DG01699  Catecholamine cardiotonic
Neuropsychiatric agent
 DG01472  Dopamine agonist
  DG01467  Dopamine D1-receptor agonist
  DG01468  Dopamine D2-receptor agonist
Remark
ATC code: 
Chemical group: 
Activity
Mydriatic, Cardiotonic, Dopamine receptor agonist
Comment
Dopamine derivative
Treatment of congestive heart failure
Target
DRD1 [HSA:1812] [KO:K04144];
DRD2 [HSA:1813] [KO:K04145]
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Gap junction
Interaction
Drug interaction
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
     C01CA16 Ibopamine
      D08057  Ibopamine hydrochloride
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01F MYDRIATICS AND CYCLOPLEGICS
    S01FB Sympathomimetics excl. antiglaucoma preparations
     S01FB03 Ibopamine
      D08057  Ibopamine hydrochloride
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    dopamine D1-receptor
     Ibopamine
      D08057  Ibopamine hydrochloride
    dopamine D2-receptor
     Ibopamine
      D08057  Ibopamine hydrochloride
BRITE hierarchy
Other DBs
CAS: 
75011-65-3
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        23
            1   X   Cl   26.9092  -20.5967
            2   C8y C    19.7400  -14.9800
            3   C8y C    19.7400  -16.4500
            4   C8x C    21.0000  -17.1500
            5   C8x C    22.1900  -16.4500
            6   C8y C    22.1900  -14.9800
            7   C8x C    21.0000  -14.2800
            8   C1b C    23.4500  -14.2800
            9   C1b C    24.6400  -14.9800
            10  N1b N    25.8300  -14.2800
            11  C1a C    27.0200  -14.9800
            12  O7a O    18.5500  -14.2800
            13  O7a O    18.5500  -17.1500
            14  C7a C    17.3600  -14.9800
            15  C1c C    16.1700  -14.3500
            16  O6a O    17.3600  -16.4500
            17  C1a C    14.9800  -14.9800
            18  C1a C    16.1700  -12.8800
            19  C7a C    18.5500  -18.5500
            20  C1c C    17.3600  -19.2500
            21  O6a O    19.8100  -19.2500
            22  C1a C    16.1700  -18.5500
            23  C1a C    17.3600  -20.6500
BOND        22
            1     2   3 2
            2     3   4 1
            3     4   5 2
            4     5   6 1
            5     6   7 2
            6     2   7 1
            7     6   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11    2  12 1
            12    3  13 1
            13   12  14 1
            14   14  15 1
            15   14  16 2
            16   15  17 1
            17   15  18 1
            18   13  19 1
            19   19  20 1
            20   19  21 2
            21   20  22 1
            22   20  23 1

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