piroheptine (CHEBI:135287)

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ChEBI Name	piroheptine

ChEBI ID	CHEBI:135287

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

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Formula

C22H25N

Net Charge

Average Mass

303.449

Monoisotopic Mass

303.19870

InChI

InChI=1S/C22H25N/c1-3-23-15-14-19(16(23)2)22-20-10-6-4-8-17(20)12-13-18-9-5-7-11-21(18)22/h4-11,16H,3,12-15H2,1-2H3

InChIKey

NKJQZSDCCLDOQH-UHFFFAOYSA-N

SMILES

CCN1CCC(C1C)=C1C2=CC=CC=C2CCC2=CC=CC=C12

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

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):	antiparkinson drug A drug used in the treatment of Parkinson's disease. muscarinic antagonist A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.

ChEBI Ontology
Outgoing	piroheptine (CHEBI:135287) has role antiparkinson drug (CHEBI:48407) piroheptine (CHEBI:135287) has role muscarinic antagonist (CHEBI:48876) piroheptine (CHEBI:135287) is a N-alkylpyrrolidine (CHEBI:46775) piroheptine (CHEBI:135287) is a carbotricyclic compound (CHEBI:38032) piroheptine (CHEBI:135287) is conjugate base of piroheptine(1+) (CHEBI:176970)

Incoming	piroheptine(1+) (CHEBI:176970) is conjugate acid of piroheptine (CHEBI:135287)

IUPAC Name

3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)-1-ethyl-2-methylpyrrolidine

Registry Number	Type	Source
16378-21-5	CAS Registry Number	ChemIDplus

Last Modified

30 July 2021