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CHEBI:35040 - UCL 1684

ChEBI IDCHEBI:35040
ChEBI NameUCL 1684
Stars
DefinitionA quinolinium ion that is the dication which results from the joining of two molecules of 4-aminoquinolinium via a 1,3-dimethylbenzene linker at positions 1 and 4, thus forming a cyclic structure. It is a potent blocker of Ca2+-activated K+ channels in rats.
Last Modified8 November 2021
DownloadsMolfile
FormulaC34H30N4
Net Charge+2
Average Mass494.642
Monoisotopic Mass494.24595
SMILESc1cc2cc(c1)C[n+]1ccc(c3ccccc31)NCc1ccc(cc1)CNc1cc[n+](c3ccccc13)C2
InChIInChI=1S/C34H28N4/c1-3-10-33-29(8-1)31-16-18-37(33)23-27-6-5-7-28(20-27)24-38-19-17-32(30-9-2-4-11-34(30)38)36-22-26-14-12-25(13-15-26)21-35-31/h1-20H,21-24H2/p+2/b35-31+,36-32+
InChIKeyHZWVJPDDZQOYGA-QUTRQNJUSA-P
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
potassium channel blocker  An agent that inhibits cell membrane glycoproteins that are selectively permeable to potassium ions.
Application:
anti-arrhythmia drug  A drug used for the treatment or prevention of cardiac arrhythmias. Anti-arrhythmia drugs may affect the polarisation-repolarisation phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibres.
ChEBI Ontology
Outgoing Relation(s)
UCL 1684 (CHEBI:35040) has role anti-arrhythmia drug (CHEBI:38070)
UCL 1684 (CHEBI:35040) has role potassium channel blocker (CHEBI:50509)
UCL 1684 (CHEBI:35040) is a aromatic amine (CHEBI:33860)
UCL 1684 (CHEBI:35040) is a azamacrocycle (CHEBI:52898)
UCL 1684 (CHEBI:35040) is a benzenes (CHEBI:22712)
UCL 1684 (CHEBI:35040) is a quinolinium ion (CHEBI:52837)
UCL 1684 (CHEBI:35040) is a secondary amino compound (CHEBI:50995)
IUPAC Name 
17,24-diaza-1,9-diazoniaheptacyclo[23.6.2.29,16.219,22.13,7.010,15.026,31]octatriaconta-1(32),3(38),4,6,9(37),10(15),11,13,16(36),19,21,25(33),26(31),27,29,34-hexadecaene
Synonyms  Source
UCL-1684ChEBI
6,10-diaza-3(1,3),8(1,4)-dibenzena-1,5(1,4)-diquinolinacyclodecaphaneKEGG COMPOUND
1λ5,9λ5,17,24-tetraazaheptacyclo[23.6.2.29,16.219,22.13,7.010,15.026,31]octatriaconta-1(32),3(38),4,6,9(37),10(15),11,13,16(36),19,21,25(33),26(31),27,29,34-hexadecaene-1,9-bis(ylium)IUPAC
UCL1684ChEBI
11λ5,51λ5-6,10-diaza-3(1,3),8(1,4)-dibenzena-1,5(1,4)-diquinolinacyclodecaphane-11,51-bis(ylium)ChEBI
Manual XrefsDatabases
C13783KEGG COMPOUND
571070ChemSpider
Citations