Ethanol → [4-({3-[4-(Biphenyl-2-ylcarbamoyloxy)piperidin-1-yl]propionyl}methylamino)phenyl]acetic Acid Methyl Ester
반응식
[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][cH:7][c:8]([NH:11][CH2:12][C:13]([CH:14]=[CH2:15])=[O:16])[cH:9][cH:10]1)=[O:17].[CH3:40][CH2:41][OH:42].[NH:18]1[CH2:19][CH2:20][CH:21]([O:24][C:25]([NH:26][c:27]2[c:28](-[c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[cH:29][cH:30][cH:31][cH:32]2)=[O:39])[CH2:22][CH2:23]1>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][cH:7][c:8]([NH:11][CH2:12][C:13]([CH2:14][CH2:15][N:18]2[CH2:19][CH2:20][CH:21]([O:24][C:25]([NH:26][c:27]3[c:28](-[c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)[cH:29][cH:30][cH:31][cH:32]3)=[O:39])[CH2:22][CH2:23]2)=[O:16])[cH:9][cH:10]1)=[O:17]참가 물질
4
출처 및 근거
- ORD 기록
- ord-4533d487751f482fba9119998827f93c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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