1,3-Dibromopropane → 1-{2-(3-Bromo-propoxy)-5-chloro-3-[3-(4-fluoro-phenyl)-butoxy]-4-methoxy-6-methyl-phenyl}-ethanone
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[Br:27][CH2:28][CH2:29][CH2:30][Br:31].[Cl:1][c:2]1[c:3]([CH3:26])[c:4]([C:23]([CH3:24])=[O:25])[c:5]([OH:22])[c:6]([O:10][CH2:11][CH2:12][CH:13]([CH3:14])[c:15]2[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]2)[c:7]1[O:8][CH3:9]>>[Cl:1][c:2]1[c:3]([CH3:26])[c:4]([C:23]([CH3:24])=[O:25])[c:5]([O:22][CH2:30][CH2:29][CH2:28][Br:27])[c:6]([O:10][CH2:11][CH2:12][CH:13]([CH3:14])[c:15]2[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]2)[c:7]1[O:8][CH3:9]참가 물질
3
출처 및 근거
- ORD 기록
- ord-ac15dd7c7ee9472b914e20bd0332f863
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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