tiquizium (CHEBI:145714)

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ChEBI Name	tiquizium

ChEBI ID	CHEBI:145714

Definition	A member of the class of quinolizines that is trans-5-methyloctahydro-2H-quinolizinium which is substituted by a di(thiophen-2-yl)methylidene group at position 3. Its bromide salt is used as an antispasmodic drug.

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

Supplier Information

Download	Molfile XML SDF

Formula

C19H24NS2

Net Charge

Average Mass

330.530

Monoisotopic Mass

330.13447

InChI

InChI=1S/C19H24NS2/c1-20-11-3-2-6-16(20)10-9-15(14-20)19(17-7-4-12-21-17)18-8-5-13-22-18/h4-5,7-8,12-13,16H,2-3,6,9-11,14H2,1H3/q+1/t16-,20-/m1/s1

InChIKey

ZGSDGGRVFIYKKE-OXQOHEQNSA-N

SMILES

C(=C1C[N@+]2(C)[C@@](CC1)(CCCC2)[H])(C3=CC=CS3)C4=CC=CS4

Roles Classification
Biological Role(s):	muscarinic antagonist A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.

Application(s):	muscarinic antagonist A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists. antispasmodic drug A drug that suppresses spasms. These are usually caused by smooth muscle contraction, especially in tubular organs. The effect is to prevent spasms of the stomach, intestine or urinary bladder. anti-ulcer drug One of various classes of drugs with different action mechanisms used to treat or ameliorate peptic ulcer or irritation of the gastrointestinal tract.

ChEBI Ontology
Outgoing	tiquizium (CHEBI:145714) has role anti-ulcer drug (CHEBI:49201) tiquizium (CHEBI:145714) has role antispasmodic drug (CHEBI:53784) tiquizium (CHEBI:145714) has role muscarinic antagonist (CHEBI:48876) tiquizium (CHEBI:145714) is a quaternary ammonium ion (CHEBI:35267) tiquizium (CHEBI:145714) is a quinolizines (CHEBI:38063) tiquizium (CHEBI:145714) is a thiophenes (CHEBI:26961)

Incoming	tiquizium bromide (CHEBI:32232) has part tiquizium (CHEBI:145714)

IUPAC Name

(5R,9aR)-3-[di(thiophen-2-yl)methylidene]-5-methyloctahydro-2H-quinolizinium

Synonyms	Sources
(5R,9aR)-3-[di(thiophen-2-yl)methylidene]-5-methyloctahydro-2H-quinolizin-5-ium	IUPAC
3-(di-2-thienylmethylene)-octahydro-5-methyl-trans-quinolizinium	ChEBI
trans-3-(di-2-thienylmethylene)octahydro-5-methyl-2H-quinolizinium	ChemIDplus

Registry Number	Type	Source
149755-23-7	CAS Registry Number	ChemIDplus

Last Modified

20 December 2019