Acetic Acid → HCID 14698108, 화합물
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[CH3:21][C:22](=[O:23])[OH:24].[CH3:3][c:4]1[nH:5][c:6](=[O:19])[s:7][c:8]1[C:9]([c:10]1[cH:11][cH:12][c:13]([S:16][CH3:17])[cH:14][cH:15]1)=[O:18].[OH2:20].[OH:1][OH:2]>>[O:1]=[S:16]([c:13]1[cH:12][cH:11][c:10]([C:9]([c:8]2[c:4]([CH3:3])[nH:5][c:6](=[O:19])[s:7]2)=[O:18])[cH:15][cH:14]1)[CH3:17]참가 물질
5
출처 및 근거
- ORD 기록
- ord-939e04abdd154802b68cef40504ead2d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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