Acetic Acid → HCID 12674764, 화합물
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[CH3:19][C:20]([Cl:21])=[O:22].[CH3:23][C:24]([O:25][C:26](=[O:27])[CH3:28])=[O:29].[CH3:30][C:31](=[O:32])[OH:33].[OH:1][CH2:2][CH2:3][n:4]1[cH:5][cH:6][cH:7][cH:8]1.[S:9](=[O:10])(=[O:11])([OH:12])[OH:13].[nH:14]1[cH:15][cH:16][cH:17][cH:18]1>>[O:1]([CH2:2][CH2:3][n:4]1[cH:5][cH:6][cH:7][cH:8]1)[C:20]([CH3:19])=[O:22]참가 물질
7
출처 및 근거
- ORD 기록
- ord-90726a19327e467aacfdae83c6a02216
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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