CHEBI:145498 - donepezil (1+)

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ChEBI Name donepezil (1+)
ChEBI ID CHEBI:145498
Definition A piperidinium ion resulting from the protonation of amino group of donepezil.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C24H30NO3
Net Charge +1
Average Mass 380.507
Monoisotopic Mass 380.22202
InChI InChI=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
InChIKey ADEBPBSSDYVVLD-UHFFFAOYSA-O
SMILES C1(=C(C=C2C(=C1)CC(C2=O)(CC3CC[NH+](CC3)CC4=CC=CC=C4)[H])OC)OC
ChEBI Ontology
Outgoing donepezil (1+) (CHEBI:145498) is a piperidinium ion (CHEBI:48633)
donepezil (1+) (CHEBI:145498) is conjugate acid of donepezil (CHEBI:53289)
Incoming 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
Last Modified
26 November 2019