Acetic Acid → Stk598682
반응식
[C:20]([OH:21])(=[O:22])[CH3:23].[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([CH2:10][CH:11]2[C:12](=[O:17])[NH:13][C:14](=[O:16])[S:15]2)[cH:8][cH:9]1)=[O:18].[ClH:19].[OH2:24]>>[O:2]=[C:3]([c:4]1[cH:5][cH:6][c:7]([CH2:10][CH:11]2[C:12](=[O:17])[NH:13][C:14](=[O:16])[S:15]2)[cH:8][cH:9]1)[OH:18]참가 물질
5
출처 및 근거
- ORD 기록
- ord-813e61ab2a64427f8436f79c185b0525
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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