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6-O-Desmethyldonepezil

MNXM118464 is deprecated and here replaced by MNXM1365466
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1365466 Image of MNXM1365466
referencechebi:185875
formulaC23H27NO3
global charge0
mol weight365.473
InChIKeyDJRBBQJREIMIEU-UHFFFAOYSA-N
InChIInChI=1S/C23H27NO3/c1-27-22-13-18-12-19(23(26)20(18)14-21(22)25)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=CC2=C(C=C1O)C(=O)C(CC1CCN(CC3=CC=CC=C3)CC1)C2
MNX internals
InChI (mnx)InChI=1/C23H27NO3/c1-27-22-13-18-12-19(23(26)20(18)14-21(22)25)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 MNXM1365466
SMILES (mnx)[CH3:1][O:27][C:22]1=[C:21]([OH:25])[CH:14]=[C:20]2[C:18](=[CH:13]1)[CH2:12][CH:19]([CH2:11][CH:16]1[CH2:7][CH2:9][N:24]([CH2:15][C:17]3=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]3)[CH2:10][CH2:8]1)[C:23]2=[O:26]
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:185875
chebi:185875
DJRBBQJREIMIEU-UHFFFAOYSA-N 		6-O-Desmethyldonepezil
2-[(1-benzylpiperidin-4-yl)methyl]-6-hydroxy-5-methoxy-2,3-dihydroinden-1-one

vmhM:dnpz_6des
vmhmetabolite:dnpz_6des
DJRBBQJREIMIEU-UHFFFAOYSA-O 		6-O-Desmethyldonepezil
hmdb:HMDB0013959
DJRBBQJREIMIEU-UHFFFAOYSA-N 		6-O-Desmethyldonepezil
2-[(1-benzylpiperidin-4-yl)methyl]-6-hydroxy-5-methoxy-2,3-dihydro-1H-inden-1-one
2-[(1-benzylpiperidin-4-yl)methyl]-6-hydroxy-5-methoxy-2,3-dihydroinden-1-one
6-O-Desmethyl donepezil

hmdb:HMDB13959
vmhM:M_dnpz_6des 		secondary/obsolete/fantasy identifier