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CHEBI:55363 - (S)-azelastine

Default Structure
ChEBI IDCHEBI:55363
ChEBI Name(S)-azelastine
Stars
ASCII Name(S)-azelastine
DefinitionThe (S)-enantiomer of azelastine.
Last Modified24 August 2012
SubmitterSteve
DownloadsMolfile
FormulaC22H24ClN3O
Net Charge0
Average Mass381.907
Monoisotopic Mass381.16079
SMILESCN1CCC[C@H](n2nc(Cc3ccc(Cl)cc3)c3ccccc3c2=O)CC1
InChIInChI=1S/C22H24ClN3O/c1-25-13-4-5-18(12-14-25)26-22(27)20-7-3-2-6-19(20)21(24-26)15-16-8-10-17(23)11-9-16/h2-3,6-11,18H,4-5,12-15H2,1H3/t18-/m0/s1
InChIKeyMBUVEWMHONZEQD-SFHVURJKSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
H1-receptor antagonist  H1-receptor antagonists are the drugs that selectively bind to but do not activate histamine H1 receptors, thereby blocking the actions of endogenous histamine.
EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor  A lipoxygenase inhibitor that interferes with the action of arachidonate 5-lipoxygenase (EC 1.13.11.34).
Applications:
nasal decongestant  A drug used to relieve nasal congestion in the upper respiratory tract.
H1-receptor antagonist  H1-receptor antagonists are the drugs that selectively bind to but do not activate histamine H1 receptors, thereby blocking the actions of endogenous histamine.
bronchodilator agent  An agent that causes an increase in the expansion of a bronchus or bronchial tubes.
anti-asthmatic drug  A drug used to treat asthma.
anti-allergic agent  A drug used to treat allergic reactions.
platelet aggregation inhibitor  A drug or agent which antagonizes or impairs any mechanism leading to blood platelet aggregation, whether during the phases of activation and shape change or following the dense-granule release reaction and stimulation of the prostaglandin-thromboxane system.
ChEBI Ontology
Outgoing Relation(s)
(S)-azelastine (CHEBI:55363) is a azelastine (CHEBI:2950)
(S)-azelastine (CHEBI:55363) is enantiomer of (R)-azelastine (CHEBI:55362)
Incoming Relation(s)
(R)-azelastine (CHEBI:55362) is enantiomer of (S)-azelastine (CHEBI:55363)
IUPAC Name 
4-(4-chlorobenzyl)-2-[(4S)-1-methylazepan-4-yl]phthalazin-1(2H)-one