Ethanol → HCID 21537722, 화합물
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[CH3:1][CH2:2][C:3](=[O:4])[NH:5][c:6]1[s:7][cH:8][c:9]([CH3:20])[c:10]1[C:11]([c:12]1[c:13]([Cl:18])[cH:14][cH:15][cH:16][cH:17]1)=[O:19].[CH3:23][CH2:24][OH:25].[K+:22].[OH-:21].[OH2:26]>>[CH3:3][NH:5][c:6]1[s:7][cH:8][c:9]([CH3:20])[c:10]1[C:11]([c:12]1[c:13]([Cl:18])[cH:14][cH:15][cH:16][cH:17]1)=[O:19]참가 물질
6
출처 및 근거
- ORD 기록
- ord-3b4052d9b72641f4847f708ee01ba4f7
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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