setiptiline maleate (CHEBI:176786)

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ChEBI Name	setiptiline maleate

ChEBI ID	CHEBI:176786

Definition	A maleate salt obtained by reaction of setiptiline with one equivalent of maleic acid.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C19H19N.C4H4O4

Net Charge

Average Mass

377.440

Monoisotopic Mass

377.16271

InChI

InChI=1S/C19H19N.C4H4O4/c1-20-11-10-18-16-8-4-2-6-14(16)12-15-7-3-5-9-17(15)19(18)13-20;5-3(6)1-2-4(7)8/h2-9H,10-13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

AVPIBVPBCWBXIU-BTJKTKAUSA-N

SMILES

OC(=O)\C=C/C(O)=O.CN1CCC2=C(C1)C1=C(CC3=C2C=CC=C3)C=CC=C1

Roles Classification
Biological Role(s):	alpha-adrenergic antagonist An agent that binds to but does not activate alpha-adrenergic receptors thereby blocking the actions of endogenous or exogenous alpha-adrenergic agonists. alpha-Adrenergic antagonists are used in the treatment of hypertension, vasospasm, peripheral vascular disease, shock, and pheochromocytoma. serotonergic antagonist Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.

Application(s):	alpha-adrenergic antagonist An agent that binds to but does not activate alpha-adrenergic receptors thereby blocking the actions of endogenous or exogenous alpha-adrenergic agonists. alpha-Adrenergic antagonists are used in the treatment of hypertension, vasospasm, peripheral vascular disease, shock, and pheochromocytoma. serotonergic antagonist Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists. antidepressant Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions. (via tetracyclic antidepressant )

ChEBI Ontology
Outgoing	setiptiline maleate (CHEBI:176786) has part setiptiline(1+) (CHEBI:176784) setiptiline maleate (CHEBI:176786) has role α-adrenergic antagonist (CHEBI:37890) setiptiline maleate (CHEBI:176786) has role serotonergic antagonist (CHEBI:48279) setiptiline maleate (CHEBI:176786) is a maleate salt (CHEBI:50221) setiptiline maleate (CHEBI:176786) is a tetracyclic antidepressant (CHEBI:50940)

IUPAC Name

2-methyl-2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine (2Z)-but-2-enedioate

Synonym	Source
2,3,4,9-tetrahydro-2-methyl-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridyl maleate	ChemIDplus

Brand Name	Source
Tecipul	KEGG DRUG

Registry Number	Type	Source
85650-57-3	CAS Registry Number	ChemIDplus

Last Modified

09 July 2021