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CHEBI:53290 - (S)-donepezil

ChEBI IDCHEBI:53290
ChEBI Name(S)-donepezil
Stars
ASCII Name(S)-donepezil
DefinitionA 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one that has S configuration.
Last Modified26 November 2019
SubmitterSteve
DownloadsMolfile
FormulaC24H29NO3
Net Charge0
Average Mass379.500
Monoisotopic Mass379.21474
SMILES[H][C@]1(CC2CCN(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/t20-/m0/s1
InChIKeyADEBPBSSDYVVLD-FQEVSTJZSA-N
ChEBI Ontology
Outgoing Relation(s)
(S)-donepezil (CHEBI:53290) is a 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one (CHEBI:145499)
(S)-donepezil (CHEBI:53290) is conjugate base of (S)-donepezil(1+) (CHEBI:145503)
(S)-donepezil (CHEBI:53290) is enantiomer of (R)-donepezil (CHEBI:53292)
Incoming Relation(s)
donepezil (CHEBI:53289) has part (S)-donepezil (CHEBI:53290)
(S)-donepezil(1+) (CHEBI:145503) is conjugate acid of (S)-donepezil (CHEBI:53290)
(R)-donepezil (CHEBI:53292) is enantiomer of (S)-donepezil (CHEBI:53290)
IUPAC Name 
(2S)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one
Registry NumbersSources
Reaxys:7081957Reaxys