Ethanol → 3-(4-Fluorophenyl)-5-methylisoxazole-4-carboxylic acid
반응식
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7](-[c:12]2[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]2)[n:8][o:9][c:10]1[CH3:11].[CH3:21][CH2:22][OH:23].[Na+:20].[OH-:19]>>[O:3]=[C:4]([OH:5])[c:6]1[c:7](-[c:12]2[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]2)[n:8][o:9][c:10]1[CH3:11]참가 물질
5
출처 및 근거
- ORD 기록
- ord-9508441b02024ffaa94707a8ea07ca1e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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