HRID189735

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

结构：COc1cc2c(cc1OC)C(=O)C(CC1CCN(Cc3ccccc3)CC1)C2

HCID3152

Donepezil

C24H29NO3

HCID6395

Methanesulfonic acid

CH4O3S

HCID8857

Ethyl acetate

C4H8O2

PRODUCTS

生成物

HCID3152

Donepezil

C24H29NO3

HCID6395

Methanesulfonic acid

CH4O3S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2641eb71c880425d9eaddfdfffc68116
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[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][S:30]([OH:31])(=[O:32])=[O:33].[CH3:34][CH2:35][O:36][C:37](=[O:38])[CH3:39].[CH3:40][CH2:41][OH:42]>>[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][S:30](=[O:31])(=[O:32])[OH:33]