4-Phenylcyclohexanone → 3-Fluoro-N-{[1-(4-phenyl-cyclohexyl)-azetidin-3-ylcarbamoyl]-methyl}-5-trifluoromethyl-benzamide
반응식
[NH:14]1[CH2:15][CH:16]([NH:18][C:19](=[O:20])[CH2:21][NH:22][C:23]([c:24]2[cH:25][c:26]([C:31]([F:32])([F:33])[F:34])[cH:27][c:28]([F:30])[cH:29]2)=[O:35])[CH2:17]1.[c:1]1([CH:7]2[CH2:8][CH2:9][C:10](=[O:13])[CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[CH2:8][CH2:9][CH:10]([N:14]3[CH2:15][CH:16]([NH:18][C:19](=[O:20])[CH2:21][NH:22][C:23]([c:24]4[cH:25][c:26]([C:31]([F:32])([F:33])[F:34])[cH:27][c:28]([F:30])[cH:29]4)=[O:35])[CH2:17]3)[CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-220014a563c84c708915dc54b85cf43e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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