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CHEBI:77615 - terbinafine(1+)

ChEBI IDCHEBI:77615
ChEBI Nameterbinafine(1+)
Stars
DefinitionAn organic cation that is the conjugate acid of terbinafine, obtained by protonation of the amino group; major species at pH 7.3.
Last Modified24 July 2015
SubmitterSteve
DownloadsMolfile
FormulaC21H26N
Net Charge+1
Average Mass292.446
Monoisotopic Mass292.20598
SMILESC[NH+](C/C=C/C#CC(C)(C)C)Cc1cccc2ccccc12
InChIInChI=1S/C21H25N/c1-21(2,3)15-8-5-9-16-22(4)17-19-13-10-12-18-11-6-7-14-20(18)19/h5-7,9-14H,16-17H2,1-4H3/p+1/b9-5+
InChIKeyDOMXUEMWDBAQBQ-WEVVVXLNSA-O
ChEBI Ontology
Outgoing Relation(s)
terbinafine(1+) (CHEBI:77615) is a ammonium ion derivative (CHEBI:35274)
terbinafine(1+) (CHEBI:77615) is a organic cation (CHEBI:25697)
terbinafine(1+) (CHEBI:77615) is conjugate acid of terbinafine (CHEBI:9448)
Incoming Relation(s)
terbinafine hydrochloride (CHEBI:77614) has part terbinafine(1+) (CHEBI:77615)
terbinafine (CHEBI:9448) is conjugate base of terbinafine(1+) (CHEBI:77615)
IUPAC Name 
(2E)-N,6,6-trimethyl-N-(1-naphthylmethyl)hept-2-en-4-yn-1-aminium
Synonym  Source
terbinafine cationChEBI