Acetate → HCID 18437794, 화합물
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[CH2:1]([CH2:2][CH2:3][CH3:4])[n:5]1[c:6]([I:16])[n:7][c:8](-[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:9]1.[CH2:21]=[O:22].[CH3:17][C:18]([OH:19])=[O:20].[CH3:24][C:25](=[O:26])[O-:27].[Na+:23].[OH2:28]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[n:5]1[c:6]([I:16])[n:7][c:8](-[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[c:9]1[CH2:18][OH:19]참가 물질
7
출처 및 근거
- ORD 기록
- ord-91ba5e4c56a24152a3ae5903719101a8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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