3-Isoxazolamine → 1-(5-tert-Butyl-isoxazol-3-ylcarbamoyl)-propyl-carbamic acid tert-butyl ester
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][CH2:10][CH3:11])[C:12]([NH:13][c:14]1[n:15][o:16][c:17]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:18]1)=[O:23])=[O:24].[NH2:25][c:26]1[cH:27][cH:28][o:29][n:30]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][CH3:10])[C:12]([NH:13][c:14]1[n:15][o:16][c:17]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:18]1)=[O:23])=[O:24]참가 물질
3
출처 및 근거
- ORD 기록
- ord-5a82eb136f2242f9a52784b3bef5bb38
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
반응 노트
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