Acetate → HCID 136400709, 화합물
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[C:32]([O-:33])(=[O:34])[CH3:35].[C:37]([OH:38])(=[O:39])[CH3:40].[CH3:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10](=[O:20])[n:11]1-[c:12]1[cH:13][c:14]([Cl:19])[c:15]([Cl:18])[cH:16][cH:17]1.[Na+:36].[OH:21][c:22]1[c:23]([CH:24]=[O:25])[cH:26][cH:27][cH:28][c:29]1[O:30][CH3:31]>>[CH:1]([c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10](=[O:20])[n:11]1-[c:12]1[cH:13][c:14]([Cl:19])[c:15]([Cl:18])[cH:16][cH:17]1)=[CH:24][c:23]1[c:22]([OH:21])[c:29]([O:30][CH3:31])[cH:28][cH:27][cH:26]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-54d130e22a9c4aed8b203878c56a5072
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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