Acetic Acid → HCID 53873990, 화합물
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[CH3:19][OH:20].[CH3:1][O:2][C:3]([CH2:4][NH:5][c:6]1[cH:7][c:8]([O:12][CH3:13])[cH:9][cH:10][cH:11]1)=[O:14].[CH3:24][C:25](=[O:26])[OH:27].[Cl:21][CH2:22][Cl:23].[N:15]([O-:16])=[O:17].[Na+:18].[OH2:29].[Zn:28]>>[CH3:1][O:2][C:3]([CH2:4][N:5]([c:6]1[cH:7][c:8]([O:12][CH3:13])[cH:9][cH:10][cH:11]1)[NH2:15])=[O:14]참가 물질
9
출처 및 근거
- ORD 기록
- ord-4f21e3323ad540e4840aeed701a3c87e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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