pyrvinium (CHEBI:8687)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	pyrvinium

ChEBI ID	CHEBI:8687

Definition	A quinolinium ion that is 1-methylquinolinium substituted by dimethylamino group at position 6 and a (E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)ethenyl at position 2. It is a anthelminthic drug active against pinworms. The salts of pyrvinium can also be used as anticancer agents.

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

Supplier Information

Download	Molfile XML SDF

more structures >>

Wikipedia	License

Read full article at Wikipedia

Formula

C26H28N3

Net Charge

Average Mass

382.52060

Monoisotopic Mass

382.22777

InChI

InChI=1S/C26H28N3/c1-19-17-21(20(2)29(19)24-9-7-6-8-10-24)11-13-23-14-12-22-18-25(27(3)4)15-16-26(22)28(23)5/h6-18H,1-5H3/q+1

InChIKey

QMHSXPLYMTVAMK-UHFFFAOYSA-N

SMILES

CN(C)c1ccc2[n+](C)c(\C=C\c3cc(C)n(c3C)-c3ccccc3)ccc2c1

Roles Classification
Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. anthelminthic drug Substance intended to kill parasitic worms (helminths).

ChEBI Ontology
Outgoing	pyrvinium (CHEBI:8687) has role anthelminthic drug (CHEBI:35443) pyrvinium (CHEBI:8687) has role antineoplastic agent (CHEBI:35610) pyrvinium (CHEBI:8687) is a quinolinium ion (CHEBI:52837)

IUPAC Name

6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)ethenyl]-1-methylquinolinium

Citation	Type	Source
22332749	PubMed citation	Europe PMC

Last Modified

22 February 2017