KEGG   COMPOUND: C13591
Entry
C13591                      Compound                               
Name
Metipranolol hydrochloride
Formula
C17H27NO4. HCl
Exact mass
345.1707
Mol weight
345.8615
Structure
Remark
Same as: D02081
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
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01466  Adrenergic receptor antagonist
   DG01464  beta-Adrenergic receptor antagonist (Beta blocker)
    DG01137  Metipranolol
     D02081  Metipranolol hydrochloride
 Ophthalmic agent
  DG03201  Intraocular pressure lowering agent
   DG01137  Metipranolol
    D02081  Metipranolol hydrochloride
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRB
     D02081  Metipranolol hydrochloride
Other DBs
CAS: 36592-77-5
PubChem: 853953
ChEBI: 34845
NIKKAJI: J2.784.705F
LinkDB
KCF data

ATOM        23
            1   X   Cl   41.0200  -17.4300
            2   C8y C    26.6700  -16.4500
            3   C8y C    26.6700  -17.9200
            4   C8y C    27.9300  -18.6200
            5   C8y C    29.1200  -17.9200
            6   C8x C    29.1200  -16.4500
            7   C8y C    27.9300  -15.7500
            8   C1a C    27.9300  -14.3500
            9   C1a C    27.9300  -20.0200
            10  C1a C    25.4800  -18.6200
            11  O7a O    25.4800  -15.7500
            12  C7a C    24.2900  -16.4500
            13  C1a C    23.1000  -15.7500
            14  O6a O    24.2900  -17.9200
            15  O2a O    30.3800  -18.6200
            16  C1b C    31.5700  -17.9200
            17  C1c C    32.6900  -18.6200
            18  C1b C    33.8800  -17.9200
            19  O1a O    32.6900  -20.0200
            20  N1b N    35.0700  -18.6200
            21  C1c C    36.2600  -17.9200
            22  C1a C    37.5200  -18.6200
            23  C1a C    36.2600  -16.4500
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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