KEGG   DRUG: D02081Help
Entry
D02081                      Drug                                   

Name
Metipranolol hydrochloride;
Optipranolol (TN)
Formula
C17H27NO4. HCl
Exact mass
345.1707
Mol weight
345.8615
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
ATC code: 
Drug group: 
Target
beta1-adrenergic receptor antagonist [HSA:153] [KO:K04141];
beta2-adrenergic receptor antagonist [HSA:154] [KO:K04142];
beta3-adrenergic receptor antagonist [HSA:155] [KO:K04143]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04261  Adrenergic signaling in cardiomyocytes
hsa04970  Salivary secretion  
 
Interaction
Drug interaction
Structure map
Antiglaucoma agents
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
    S01ED Beta blocking agents
     S01ED04 Metipranolol
      D02081  Metipranolol hydrochloride
USP drug classification [BR:br08302]
 Ophthalmic Agents
  Ophthalmic Antiglaucoma Agents
   Metipranolol
    D02081  Metipranolol hydrochloride
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Metipranolol
      D02081  Metipranolol hydrochloride
    beta2-adrenergic receptor
     Metipranolol
      D02081  Metipranolol hydrochloride
    beta3-adrenergic receptor
     Metipranolol
      D02081  Metipranolol hydrochloride
BRITE hierarchy
Other DBs
CAS: 
36592-77-5
PubChem: 
DrugBank: 
LigandBox: 
KCF data Show

ATOM        23
            1   X   Cl   41.5333  -17.8267
            2   C8y C    27.0900  -16.8700
            3   C8y C    27.0900  -18.3400
            4   C8y C    28.3500  -19.0400
            5   C8y C    29.5400  -18.3400
            6   C8x C    29.5400  -16.8700
            7   C8y C    28.3500  -16.1700
            8   C1a C    28.3500  -14.7700
            9   C1a C    28.3500  -20.4400
            10  C1a C    25.9000  -19.0400
            11  O7a O    25.9000  -16.1700
            12  C7a C    24.7100  -16.8700
            13  C1a C    23.5200  -16.1700
            14  O6a O    24.7100  -18.3400
            15  O2a O    30.8000  -19.0400
            16  C1b C    31.9900  -18.3400
            17  C1c C    33.1800  -19.0400
            18  C1b C    34.3700  -18.3400
            19  O1a O    33.1800  -20.4400
            20  N1b N    35.5600  -19.0400
            21  C1c C    36.7500  -18.3400
            22  C1a C    38.0100  -19.0400
            23  C1a C    36.7500  -16.8700
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     7   8 1
            8     4   9 1
            9     3  10 1
            10    2  11 1
            11   11  12 1
            12   12  13 1
            13   12  14 2
            14    5  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   17  19 1
            19   18  20 1
            20   20  21 1
            21   21  22 1
            22   21  23 1

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