Carbon Dioxide → methyl 3-(6-(cyclohexyl(2-methyl-4-(4-(trifluoromethyl)-1H-pyrazol-1-yl)phenyl)methylamino)nicotinamido)propanoate
반응식
[C:43](=[O:44])=[O:45].[CH3:46][CH2:47][OH:48].[CH:1]1([N:7]([c:8]2[n:9][cH:10][c:11]([C:12](=[O:13])[O:14][CH3:15])[cH:16][cH:17]2)[CH2:18][c:19]2[c:20]([CH3:34])[cH:21][c:22](-[n:25]3[n:26][cH:27][c:28]([C:30]([F:31])([F:32])[F:33])[cH:29]3)[cH:23][cH:24]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[ClH:35].[NH2:36][CH2:37][CH2:38][C:39](=[O:40])[O:41][CH3:42]>>[CH:1]1([N:7]([c:8]2[n:9][cH:10][c:11]([C:12](=[O:13])[NH:36][CH2:37][CH2:38][C:39](=[O:40])[O:41][CH3:42])[cH:16][cH:17]2)[CH2:18][c:19]2[c:20]([CH3:34])[cH:21][c:22](-[n:25]3[n:26][cH:27][c:28]([C:30]([F:31])([F:32])[F:33])[cH:29]3)[cH:23][cH:24]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1참가 물질
6
반응물 5
생성물 1
출처 및 근거
- ORD 기록
- ord-01266d1d124349629211d224ee4eb67f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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