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5-O-desmethyldonepezil

MNXM118287 is deprecated and here replaced by MNXM1365438
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1365438 Image of MNXM1365438
referencechebi:145216
formulaC23H27NO3
global charge0
mol weight365.473
InChIKeyDSMISVLYMKJMLP-UHFFFAOYSA-N
InChIInChI=1S/C23H27NO3/c1-27-22-14-20-18(13-21(22)25)12-19(23(20)26)11-16-7-9-24(10-8-16)15-17-5-3-2-4-6-17/h2-6,13-14,16,19,25H,7-12,15H2,1H3
SMILESCOC1=C(O)C=C2CC(CC3CCN(CC4=CC=CC=C4)CC3)C(=O)C2=C1
MNX internals
InChI (mnx)InChI=1/C23H27NO3/c1-27-22-14-20-18(13-21(22)25)12-19(23(20)26)11-16-7-9-24(10-8-16)15-17-5-3-2-4-6-17/h2-6,13-14,16,19,25H,7-12,15H2,1H3/t19? Image of MNXM1365438
SMILES (mnx)[CH3:1][O:27][C:22]1=[C:21]([OH:25])[CH:13]=[C:18]2[CH2:12][CH:19]([CH2:11][CH:16]3[CH2:7][CH2:9][N:24]([CH2:15][C:17]4=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]4)[CH2:10][CH2:8]3)[C:23](=[O:26])[C:20]2=[CH:14]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:145216
chebi:145216
DSMISVLYMKJMLP-UHFFFAOYSA-N 		5-O-desmethyldonepezil
1-benzyl-4-(5-hydroxy-6-methoxy-1-oxo-indan-2-yl)methylpiperidine
2-(1-benzylpiperidine-4-ylmethyl)-5-hydroxy-6-methoxyindan-1-one
2-[(1-benzyl-4-piperidinyl)methyl]-5-hydroxy-6-methoxyindan-1-one
2-[(1-benzylpiperidin-4-yl)methyl]-5-hydroxy-6-methoxy-2,3-dihydro-1H-inden-1-one
2-[(1-benzylpiperidin-4-yl)methyl]-5-hydroxy-6-methoxy-2,3-dihydroinden-1-one
5-O-desmethyl donepezil

vmhM:dnpz_5des
vmhmetabolite:dnpz_5des
DSMISVLYMKJMLP-UHFFFAOYSA-O 		5-O-Desmethyl Donepezil
hmdb:HMDB0013958
DSMISVLYMKJMLP-UHFFFAOYSA-N 		5-O-Desmethyldonepezil
2-[(1-benzylpiperidin-4-yl)methyl]-5-hydroxy-6-methoxy-2,3-dihydro-1H-inden-1-one
2-[(1-benzylpiperidin-4-yl)methyl]-5-hydroxy-6-methoxy-2,3-dihydroinden-1-one

hmdb:HMDB13958
vmhM:M_dnpz_5des 		secondary/obsolete/fantasy identifier