Acetate → HCID 136393701, 화합물
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[CH2:9]([CH3:10])[O:11][C:12]([C:13]([c:14]1[cH:15][nH:16][c:17]2[c:18]([CH2:23][CH3:24])[cH:19][cH:20][cH:21][c:22]12)=[O:25])=[O:26].[CH3:28][CH2:29][OH:30].[CH3:2][C:3](=[O:4])[O-:5].[ClH:6].[NH2:7][OH:8].[Na+:1].[OH2:27]>>[N:7]([OH:8])=[C:13]([C:12]([O:11][CH2:9][CH3:10])=[O:26])[c:14]1[cH:15][nH:16][c:17]2[c:18]([CH2:23][CH3:24])[cH:19][cH:20][cH:21][c:22]12참가 물질
8
출처 및 근거
- ORD 기록
- ord-37490980f39e41e28a32d72a03b379d0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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