Tert-butyl 2-(piperidin-4-yl)acetate → N-4-cyanobenzoyl-beta-styryl-alpha,alpha-dimethyl-beta-alanyl-4-piperidineacetic acid t-butyl ester
반응식
[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][CH:10]([C:11]([C:12](=[O:13])[OH:14])([CH3:15])[CH3:16])[CH:17]=[CH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:25][cH:26]1.[C:27]([CH3:28])([CH3:29])([CH3:30])[O:31][C:32]([CH2:33][CH:34]1[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]1)=[O:40]>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][CH:10]([C:11]([C:12](=[O:13])[N:37]2[CH2:36][CH2:35][CH:34]([CH2:33][C:32]([O:31][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:40])[CH2:39][CH2:38]2)([CH3:15])[CH3:16])[CH:17]=[CH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:25][cH:26]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-97232adeaa24484e905b45545ba38d50
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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