Acetate → HCID 85545547, 화합물
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[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[c:6]([O:15][CH3:16])[cH:7][c:8]([CH:9]=[CH:10][CH:11]=[O:12])[cH:13][cH:14]1.[CH3:21][C:22](=[O:23])[O-:24].[CH3:25][OH:26].[ClH:17].[NH2:18][OH:19].[Na+:20]>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[c:6]([O:15][CH3:16])[cH:7][c:8]([CH:9]=[CH:10][CH:11]=[N:18][OH:19])[cH:13][cH:14]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-9426b7060b4d4c95b02227948822031c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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