Acetate → HCID 66707798, 화합물
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[CH3:22][C:23](=[O:24])[O-:25].[CH3:26][C:27](=[O:28])[OH:29].[N+:17](=[O:18])([O-:19])[CH3:20].[NH4+:21].[n:1]1[c:2]([CH2:7][CH2:8][c:9]2[cH:10][cH:11][c:12]([CH:13]=[O:14])[cH:15][cH:16]2)[cH:3][cH:4][cH:5][cH:6]1>>[n:1]1[c:2]([CH2:7][CH2:8][c:9]2[cH:10][cH:11][c:12]([CH:13]=[CH:20][N+:17](=[O:18])[O-:19])[cH:15][cH:16]2)[cH:3][cH:4][cH:5][cH:6]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-e8437a512d54413a897624e38f7ed275
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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