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CHEBI:59187 - (S)-bevantolol hydrochloride

Default Structure
ChEBI IDCHEBI:59187
ChEBI Name(S)-bevantolol hydrochloride
Stars
ASCII Name(S)-bevantolol hydrochloride
DefinitionThe hydrochloride salt of (S)-bevantolol.
Last Modified22 April 2010
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H28NO4.Cl
Net Charge0
Average Mass381.900
Monoisotopic Mass381.17069
SMILESCOc1ccc(CC[NH2+]C[C@H](O)COc2cccc(C)c2)cc1OC.[Cl-]
InChIInChI=1S/C20H27NO4.ClH/c1-15-5-4-6-18(11-15)25-14-17(22)13-21-10-9-16-7-8-19(23-2)20(12-16)24-3;/h4-8,11-12,17,21-22H,9-10,13-14H2,1-3H3;1H/t17-;/m0./s1
InChIKeyFJTKCFSPYUMXJB-LMOVPXPDSA-N
Roles Classification
Biological Roles:
calcium channel blocker  One of a class of drugs that acts by selective inhibition of calcium influx through cell membranes or on the release and binding of calcium in intracellular pools.
beta-adrenergic antagonist  An agent that binds to but does not activate β-adrenergic receptors thereby blocking the actions of endogenous or exogenous β-adrenergic agonists. β-Adrenergic antagonists are used for treatment of hypertension, cardiac arrhythmias, angina pectoris, glaucoma, migraine headaches and anxiety.
Applications:
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
anti-arrhythmia drug  A drug used for the treatment or prevention of cardiac arrhythmias. Anti-arrhythmia drugs may affect the polarisation-repolarisation phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibres.
beta-adrenergic antagonist  An agent that binds to but does not activate β-adrenergic receptors thereby blocking the actions of endogenous or exogenous β-adrenergic agonists. β-Adrenergic antagonists are used for treatment of hypertension, cardiac arrhythmias, angina pectoris, glaucoma, migraine headaches and anxiety.
ChEBI Ontology
Outgoing Relation(s)
(S)-bevantolol hydrochloride (CHEBI:59187) is a bevantolol hydrochloride (CHEBI:31282)
(S)-bevantolol hydrochloride (CHEBI:59187) is enantiomer of (R)-bevantolol hydrochloride (CHEBI:59186)
Incoming Relation(s)
(R)-bevantolol hydrochloride (CHEBI:59186) is enantiomer of (S)-bevantolol hydrochloride (CHEBI:59187)
IUPAC Name 
(2S)-1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-(3-methylphenoxy)propan-2-ol hydrochloride
Synonyms  Source
(2S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-hydroxy-3-(3-methylphenoxy)propan-1-aminium chlorideIUPAC
(S)-bevantolol HClChEBI