Ethanol → HCID 53642864, 화합물
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[CH3:1][N:2]1[C:3](=[O:15])[N:4]([N:11]=[C:12]([CH3:13])[CH3:14])[CH:5]([S:9][CH3:10])[NH:6][C:7]1=[O:8].[CH3:27][CH2:28][OH:29].[c:16]1([CH3:17])[cH:18][cH:19][c:20]([S:21]([OH:22])(=[O:23])=[O:24])[cH:25][cH:26]1>>[CH3:1][N:2]1[C:3](=[O:15])[N:4]([NH2:11])[CH:5]([S:9][CH3:10])[NH:6][C:7]1=[O:8]참가 물질
4
출처 및 근거
- ORD 기록
- ord-af622a2c2233424199a01bca45884d38
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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