Ethanol → HCID 21537730, 화합물
반응식
[CH3:23][C:24]([Cl:25])=[O:26].[CH3:28][CH2:29][OH:30].[NH2:1][c:2]1[s:3][cH:4][c:5]([CH3:16])[c:6]1[C:7]([c:8]1[c:9]([Cl:14])[cH:10][cH:11][cH:12][cH:13]1)=[O:15].[OH2:27].[cH:17]1[cH:18][cH:19][n:20][cH:21][cH:22]1>>[NH:1]([c:2]1[s:3][cH:4][c:5]([CH3:16])[c:6]1[C:7]([c:8]1[c:9]([Cl:14])[cH:10][cH:11][cH:12][cH:13]1)=[O:15])[C:24]([CH3:23])=[O:26]참가 물질
6
출처 및 근거
- ORD 기록
- ord-4ddbdafa9f1e4f75ae79eef8b9ea5392
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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