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CHEBI:347401 - pentolinium ion

ChEBI IDCHEBI:347401
ChEBI Namepentolinium ion
Stars
DefinitionA dication whose structure comprises a pentane backbone linking two 1-methylpyrrolidinium groups; a nicotinic antagonist used as a ganglionic blocking agent in hypertension.
Last Modified22 February 2017
DownloadsMolfile
FormulaC15H32N2
Net Charge+2
Average Mass240.435
Monoisotopic Mass240.25545
SMILESC[N+]1(CCCCC[N+]2(C)CCCC2)CCCC1
InChIInChI=1S/C15H32N2/c1-16(12-6-7-13-16)10-4-3-5-11-17(2)14-8-9-15-17/h3-15H2,1-2H3/q+2
InChIKeyXSBSKEQEUFOSDD-UHFFFAOYSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
pentolinium ion (CHEBI:347401) has part pyrrolidinium ion (CHEBI:52145)
pentolinium ion (CHEBI:347401) is a organic cation (CHEBI:25697)
Incoming Relation(s)
pentolinium tartrate (CHEBI:55326) has part pentolinium ion (CHEBI:347401)
IUPAC Name 
1,1'-pentane-1,5-diylbis(1-methylpyrrolidinium)
Synonyms  Source
PentoloniumChemIDplus
PentolonumChemIDplus
pentolineumChEBI
Manual XrefsDatabases
DB01090DrugBank
PentoliniumWikipedia
LSM-5561LINCS
2096DrugCentral
Registry NumbersSources
Beilstein:3905671Beilstein
CAS:144-44-5ChemIDplus