Acetic Acid → HCID 22477756, 화합물
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[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([CH2:10][CH3:11])[cH:6][cH:7][cH:8][cH:9]1.[CH3:17][C:18]([O:19][C:20](=[O:21])[CH3:22])=[O:23].[CH3:24][C:25](=[O:26])[OH:27].[OH2:16].[OH:12][N+:13]([O-:14])=[O:15]>>[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([CH2:10][CH3:11])[cH:6][c:7]([N+:13](=[O:12])[O-:14])[cH:8][cH:9]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-fd36d48f3d08400a8c62ebe1f10fd0ee
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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