Ethanol → Fenoprofen
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[CH3:1][CH2:2][OH:3].[K+:22].[O:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[c:11]1[cH:12][c:13]([CH:17]([C:18]#[N:19])[CH3:20])[cH:14][cH:15][cH:16]1.[OH-:21].[OH2:23]>>[O:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[c:11]1[cH:12][c:13]([CH:17]([C:18](=[O:21])[OH:23])[CH3:20])[cH:14][cH:15][cH:16]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-fff5c0ed9baa4eaab7159ae5bd7629aa
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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