Methanol → 5-Bromo-4-isopropoxy-3-methyl-benzofuran-2-carboxylic acid
반응식
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([c:7]([CH3:15])[c:8]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[o:9]2)[c:16]1[O:17][CH:18]([CH3:19])[CH3:20].[CH2:21]1[O:22][CH2:23][CH2:24][CH2:25]1.[CH3:26][OH:27]>>[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([c:7]([CH3:15])[c:8]([C:10](=[O:11])[OH:12])[o:9]2)[c:16]1[O:17][CH:18]([CH3:19])[CH3:20]참가 물질
4
출처 및 근거
- ORD 기록
- ord-668877af22594646a9e61190d9307872
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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