Acetic Acid → HCID 20213361, 화합물
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[CH3:1][n:2]1[c:3](=[O:18])[n:4]([CH3:17])[c:5](=[O:16])[cH:6][c:7]1-[c:8]1[cH:9][cH:10][c:11]([O:14][CH3:15])[cH:12][cH:13]1.[CH3:25][C:26](=[O:27])[OH:28].[Na+:24].[OH-:23].[OH:19][N+:20]([O-:21])=[O:22]>>[CH3:1][n:2]1[c:3](=[O:18])[n:4]([CH3:17])[c:5](=[O:16])[cH:6][c:7]1-[c:8]1[cH:9][cH:10][c:11]([O:14][CH3:15])[c:12]([N+:20](=[O:19])[O-:21])[cH:13]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-bf0b3a1083b74b8b9f1cd0d76e96378f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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