Ethanol → N-[[3-[4-(azetidin-3-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

반응식

[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[CH3:39][CH2:40][OH:41].[F:1][c:2]1[cH:3][c:4]([N:22]2[C:23](=[O:32])[O:24][CH:25]([CH2:27][NH:28][C:29]([CH3:30])=[O:31])[CH2:26]2)[cH:5][cH:6][c:7]1[CH:8]1[CH2:9][N:10]([C:12]([O:13][CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)=[O:21])[CH2:11]1>>[F:1][c:2]1[cH:3][c:4]([N:22]2[C:23](=[O:32])[O:24][CH:25]([CH2:27][NH:28][C:29]([CH3:30])=[O:31])[CH2:26]2)[cH:5][cH:6][c:7]1[CH:8]1[CH2:9][NH:10][CH2:11]1

참가 물질

반응물 3

HCID 702Ethanol

HCID 8857Ethyl Acetate

HCID 22625692Benzyl 3-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]azetidine-1-carboxylate

생성물 1

HCID 22625698N-[[3-[4-(azetidin-3-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

출처 및 근거

ORD 기록: ord-55b3eca908b6490b8d521c4c757db5b3
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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