Ethanol → HCID 20225719, 화합물
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[CH3:19][CH2:20][OH:21].[CH:15](=[O:16])[NH:17][NH2:18].[F:1][c:2]1[cH:3][c:4]([CH2:5][N:6]=[C:7]=[S:8])[cH:9][c:10]([F:14])[c:11]1[O:12][CH3:13]>>[F:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][C:7](=[S:8])[NH:18][NH:17][CH:15]=[O:16])[cH:9][c:10]([F:14])[c:11]1[O:12][CH3:13]참가 물질
4
출처 및 근거
- ORD 기록
- ord-b0fabcc295ec479284a6d73e351de4d8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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