Potassium Cation → Ethyl 3-[4-(2-t-butoxycarbonylaminoethoxy)phenyl]-2-(4-methylphenoxy)propionate
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[C:38](=[O:39])([O-:40])[O-:41].[CH3:23][S:24]([O:25][CH2:28][CH2:29][NH:30][C:31]([O:32][C:33]([CH3:34])([CH3:35])[CH3:36])=[O:37])(=[O:26])=[O:27].[K+:42].[K+:43].[OH:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[O:15][c:16]2[cH:17][cH:18][c:19]([CH3:22])[cH:20][cH:21]2)[cH:6][cH:7]1>>[O:1]([c:2]1[cH:3][cH:4][c:5]([CH2:8][CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[O:15][c:16]2[cH:17][cH:18][c:19]([CH3:22])[cH:20][cH:21]2)[cH:6][cH:7]1)[CH2:28][CH2:29][NH:30][C:31]([O:32][C:33]([CH3:34])([CH3:35])[CH3:36])=[O:37]참가 물질
5
출처 및 근거
- ORD 기록
- ord-b2fea3483cb34e7d8484e7fd1a5d3605
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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