Acetone → Donepezil

HRID 2126675Notes

Reaction equation

HRID 2126675 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:24]([cH:25][c:26]1[O:27][CH3:28])[C:22](=[O:23])[CH:7]([CH2:8][CH:9]1[CH2:10][CH2:11][N:12]([CH2:15][c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:13][CH2:14]1)[CH2:6]2.[CH3:29][C:30](=[O:31])[O:32][c:33]1[cH:34][cH:35][cH:36][cH:37][c:38]1[C:39]([OH:40])=[O:41].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[CH3:48][C:49](=[O:50])[CH3:51]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:24]([cH:25][c:26]1[O:27][CH3:28])[C:22](=[O:23])[CH:7]([CH2:8][CH:9]1[CH2:10][CH2:11][N:12]([CH2:15][c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:13][CH2:14]1)[CH2:6]2.[CH3:29][C:30](=[O:31])[O:32][c:33]1[cH:34][cH:35][cH:36][cH:37][c:38]1[C:39](=[O:40])[O-:41]

Participants

6

Reactant 4

HCID 180AcetoneHCID 2244AspirinHCID 3152DonepezilHCID 8857Ethyl Acetate

Product 2

HCID 3152DonepezilHCID 3434975Benzoic acid, 2-(acetyloxy)-, ion(1-)

Sources & evidence

ORD record
ord-3ba0b06946384925888fe287e531f8dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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