KEGG   DRUG: MetoprololHelp
Entry
D02358                      Drug                                   

Name
Metoprolol (USAN/INN)
Formula
C15H25NO3
Exact mass
267.1834
Mol weight
267.3639
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01653  Antiarrhythmics
  DG01806  Class II antiarrhythmic agent
 DG01466  Adrenergic receptor antagonist
  DG01464  beta-Adrenergic receptor antagonist
   DG01461  beta1-Adrenergic receptor antagonist
Enzyme substrate
 DG01644  CYP2D6 substrate
Remark
Same as: C07202
ATC code: C07AB02
Chemical structure group: DG00313
Product (DG00313): D00601<JP/US> D00635<US>
Efficacy
Antihypertensive, Vasodilator, beta1-Adrenergic receptor antagonist
Comment
Propranolol derivative
Target
ADRB1 [HSA:153] [KO:K04141]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04261  Adrenergic signaling in cardiomyocytes
Metabolism
Enzyme: CYP2D6 [HSA:1565]
Interaction
Drug interaction
Structure map
map07037  Antiarrhythmic drugs
map07048  Antimigraines
map07214  beta-Adrenergic receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C07 BETA BLOCKING AGENTS
   C07A BETA BLOCKING AGENTS
    C07AB Beta blocking agents, selective
     C07AB02 Metoprolol
      D02358  Metoprolol (USAN/INN)
USP drug classification [BR:br08302]
 Cardiovascular Agents
  Beta-adrenergic Blocking Agents
   Metoprolol
    D02358  Metoprolol (USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRB1
     D02358  Metoprolol (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 51384-51-1
PubChem: 7849417
ChEBI: 6904
ChEMBL: CHEMBL13
DrugBank: DB00264
LigandBox: D02358
NIKKAJI: J31.137E
LinkDB All DBs
KCF data Show

ATOM        19
            1   O2a O    19.1800  -14.6300
            2   C1b C    20.3700  -13.9300
            3   C1c C    21.5600  -14.6300
            4   C1b C    22.7500  -13.9300
            5   O1a O    21.5600  -16.0300
            6   N1b N    24.0100  -14.6300
            7   C1c C    25.2000  -13.9300
            8   C1a C    26.3900  -14.6300
            9   C1a C    25.2000  -12.6000
            10  C8y C    19.1800  -16.0300
            11  C8x C    17.9900  -16.7300
            12  C8x C    17.9900  -18.1300
            13  C8y C    19.1800  -18.8300
            14  C8x C    20.3700  -18.1300
            15  C8x C    20.3700  -16.7300
            16  C1b C    19.1800  -20.2300
            17  C1b C    17.9900  -20.9300
            18  O2a O    16.8000  -20.2300
            19  C1a C    15.6100  -20.9300
BOND        19
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     3   5 1
            5     4   6 1
            6     6   7 1
            7     7   8 1
            8     7   9 1
            9     1  10 1
            10   10  11 2
            11   11  12 1
            12   12  13 2
            13   13  14 1
            14   14  15 2
            15   10  15 1
            16   13  16 1
            17   16  17 1
            18   17  18 1
            19   18  19 1

» Japanese version   » Back

DBGET integrated database retrieval system