Water → HCID 10464759, 화합물
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[CH3:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[OH2:15].[OH:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6]([CH3:14])[c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]2[cH:13]1.[c:16]1([CH3:17])[cH:18][cH:19][c:20]([S:21]([OH:22])(=[O:23])=[O:24])[cH:25][cH:26]1>>[C:2](=[CH2:3])([CH3:4])[c:5]1[n:6]([CH3:14])[c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]2[cH:13]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-a575684054894630b4637c885b38a293
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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