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CHEBI:50214 - pizotifen maleate

Default Structure
ChEBI IDCHEBI:50214
ChEBI Namepizotifen maleate
Stars
DefinitionA maleate salt obtained by reaction of pizotifen with one equivalent of maleic acid.
Last Modified16 April 2012
SubmitterInma Spiteri
DownloadsMolfile
FormulaC19H21NS.C4H4O4
Net Charge0
Average Mass411.523
Monoisotopic Mass411.15043
SMILESCN1CCC(=C2c3ccccc3CCc3sccc32)CC1.O=C(O)/C=C\C(=O)O
InChIInChI=1S/C19H21NS.C4H4O4/c1-20-11-8-15(9-12-20)19-16-5-3-2-4-14(16)6-7-18-17(19)10-13-21-18;5-3(6)1-2-4(7)8/h2-5,10,13H,6-9,11-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
InChIKeyGGYSHFFKUHGBIK-BTJKTKAUSA-N
Roles Classification
Biological Roles:
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
muscarinic antagonist  A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
histamine antagonist  Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.
Applications:
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
muscarinic antagonist  A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
histamine antagonist  Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.
ChEBI Ontology
Outgoing Relation(s)
pizotifen maleate (CHEBI:50214) has part pizotifen(1+) (CHEBI:50318)
pizotifen maleate (CHEBI:50214) has role histamine antagonist (CHEBI:37956)
pizotifen maleate (CHEBI:50214) has role muscarinic antagonist (CHEBI:48876)
pizotifen maleate (CHEBI:50214) has role serotonergic antagonist (CHEBI:48279)
pizotifen maleate (CHEBI:50214) is a maleate salt (CHEBI:50221)
IUPAC Name 
4-(9,10-dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-ylidene)-1-methylpiperidine (2Z)but-2-enedioate
Synonyms  Source
4-(9,10-dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-ylidene)-1-methylpiperidine maleateChEBI
4-(9,10-dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-ylidene)-1-methylpiperidinium (2Z)-3-carboxybut-2-enoateIUPAC
4-(9,10-dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-ylidene)-1-methylpiperidinium hydrogen maleateChEBI
pizotifen hydrogen maleateChEBI
Registry NumbersSources
Reaxys:5720406Reaxys
CAS:24359-22-6ChemIDplus
Citations