Tetrahydrofuran → 6-Hydroxy-benzo[d]isoxazole-3-carboxylic acid (3-trifluoromethyl-phenyl)-amide
반응식
[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36].[F:1][C:2]([c:3]1[cH:4][c:5]([NH:9][C:10](=[O:11])[c:12]2[n:13][o:14][c:15]3[c:16]2[cH:17][cH:18][c:19]([O:21][CH2:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:20]3)[cH:6][cH:7][cH:8]1)([F:29])[F:30]>>[F:1][C:2]([c:3]1[cH:4][c:5]([NH:9][C:10](=[O:11])[c:12]2[n:13][o:14][c:15]3[c:16]2[cH:17][cH:18][c:19]([OH:21])[cH:20]3)[cH:6][cH:7][cH:8]1)([F:29])[F:30]참가 물질
4
출처 및 근거
- ORD 기록
- ord-04599470436a4254ad348c9c0d006cb5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
반응 노트
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