Acetic Acid → 3-Phenyl-3-(phenylsulfanyl)propanoic acid
반응식
[BrH:19].[CH3:20][C:21](=[O:22])[OH:23].[CH:1](=[CH:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[C:9]([OH:10])=[O:11].[OH2:24].[SH:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1>>[CH2:1]([CH:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[S:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[C:9]([OH:10])=[O:11]참가 물질
6
출처 및 근거
- ORD 기록
- ord-14808b2b27d1430fa5c9a8dceb3914e1
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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