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CHEBI:176341 - lanperisone(1+)

ChEBI IDCHEBI:176341
ChEBI Namelanperisone(1+)
Stars
DefinitionA tertiary ammonium ion that is the conjugate acid of lanperisone resulting from the protonation of the pyrrolidine nitrogen. Major microspecies at pH 7.3.
Last Modified4 June 2021
SubmitterAdnan
DownloadsMolfile
FormulaC15H19F3NO
Net Charge+1
Average Mass286.317
Monoisotopic Mass286.14133
SMILESC[C@H](C[NH+]1CCCC1)C(=O)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H18F3NO/c1-11(10-19-8-2-3-9-19)14(20)12-4-6-13(7-5-12)15(16,17)18/h4-7,11H,2-3,8-10H2,1H3/p+1/t11-/m1/s1
InChIKeyRYZCWZZJFAKYHX-LLVKDONJSA-O
ChEBI Ontology
Outgoing Relation(s)
lanperisone(1+) (CHEBI:176341) is a tertiary ammonium ion (CHEBI:137982)
lanperisone(1+) (CHEBI:176341) is conjugate acid of lanperisone (CHEBI:176339)
Incoming Relation(s)
lanperisone hydrochloride (CHEBI:31762) has part lanperisone(1+) (CHEBI:176341)
lanperisone (CHEBI:176339) is conjugate base of lanperisone(1+) (CHEBI:176341)
IUPAC Name 
1-{(2R)-2-methyl-3-oxo-3-[4-(trifluoromethyl)phenyl]propyl}pyrrolidinium
Synonym  Source
lanperisone cationChEBI