Water → 4-(4-Hydroxy-3,3,5-trimethyl-2-oxopyrrolidin-1-yl)-2-(trifluoromethyl)benzonitrile
반응식
[C:1]([Si:2]([CH3:3])([CH3:4])[O:6][CH:7]1[C:8]([CH3:26])([CH3:27])[C:9](=[O:25])[N:10]([c:13]2[cH:14][c:15]([C:21]([F:22])([F:23])[F:24])[c:16]([C:17]#[N:18])[cH:19][cH:20]2)[CH:11]1[CH3:12])([CH3:5])([CH3:28])[CH3:29].[CH2:31]1[O:32][CH2:33][CH2:34][CH2:35]1.[OH2:30]>>[OH:6][CH:7]1[C:8]([CH3:26])([CH3:27])[C:9](=[O:25])[N:10]([c:13]2[cH:14][c:15]([C:21]([F:22])([F:23])[F:24])[c:16]([C:17]#[N:18])[cH:19][cH:20]2)[CH:11]1[CH3:12]참가 물질
4
출처 및 근거
- ORD 기록
- ord-546be188671e47d78bcfbd213e372f77
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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