Toluene → [5-Cyclobutyl-3-(2,6-dichlorophenyl)-4-isoxazolyl]methanol
반응식
[CH2:24]([Al+:25][CH2:26][CH:27]([CH3:28])[CH3:29])[CH:30]([CH3:31])[CH3:32].[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[CH:1]1([c:5]2[c:6]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[c:7](-[c:10]3[c:11]([Cl:17])[cH:12][cH:13][cH:14][c:15]3[Cl:16])[n:8][o:9]2)[CH2:2][CH2:3][CH2:4]1.[H-:23].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1>>[CH:1]1([c:5]2[c:6]([CH2:18][OH:19])[c:7](-[c:10]3[c:11]([Cl:17])[cH:12][cH:13][cH:14][c:15]3[Cl:16])[n:8][o:9]2)[CH2:2][CH2:3][CH2:4]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-57769ace78334c49a22d45b58414e0f2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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