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CHEBI:145498 - donepezil (1+)

ChEBI IDCHEBI:145498
ChEBI Namedonepezil (1+)
Stars
DefinitionA piperidinium ion resulting from the protonation of amino group of donepezil.
Last Modified26 November 2019
SubmitterGareth Owen
DownloadsMolfile
FormulaC24H30NO3
Net Charge+1
Average Mass380.508
Monoisotopic Mass380.22202
SMILES[H]C1(CC2CC[NH+](Cc3ccccc3)CC2)Cc2cc(OC)c(OC)cc2C1=O
InChIInChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3/p+1
InChIKeyADEBPBSSDYVVLD-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
donepezil (1+) (CHEBI:145498) is a piperidinium ion (CHEBI:48633)
donepezil (1+) (CHEBI:145498) is conjugate acid of donepezil (CHEBI:53289)
Incoming Relation(s)
donepezil (CHEBI:53289) is conjugate base of donepezil (1+) (CHEBI:145498)
IUPAC Name 
1-benzyl-4-[(5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl]piperidinium