KEGG   DRUG: Ibopamine hydrochloride
Entry
D08057                      Drug                                   

Name
Ibopamine hydrochloride;
Scandine (TN)
Formula
C17H25NO4. HCl
Exact mass
343.155
Mol weight
343.8456
Structure
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: C01CA16 S01FB03
Chemical structure group: DG00223
Efficacy
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
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04728  Dopaminergic synapse
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
    DRD1
     D08057  Ibopamine hydrochloride
    DRD2
     D08057  Ibopamine hydrochloride
Other DBs
CAS: 75011-65-3
PubChem: 96024749
LigandBox: D08057
NIKKAJI: J350.197C
LinkDB
KCF data

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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