Methanol → [3-(4-Bromo-2-hydroxymethyl-phenoxy)-phenyl]-acetic acid ethyl ester
반응식
[BH4-:23].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[cH:7][c:8]([O:12][c:13]2[c:14]([CH:20]=[O:21])[cH:15][c:16]([Br:19])[cH:17][cH:18]2)[cH:9][cH:10][cH:11]1)=[O:22].[CH3:25][OH:26].[Na+:24]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[cH:7][c:8]([O:12][c:13]2[c:14]([CH2:20][OH:21])[cH:15][c:16]([Br:19])[cH:17][cH:18]2)[cH:9][cH:10][cH:11]1)=[O:22]참가 물질
5
출처 및 근거
- ORD 기록
- ord-e4b4c067aa20498a81f7904c47184c49
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
반응 노트
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