Water → HCID 23464485, 화합물
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[BH3:20].[CH3:21][CH2:22][O:23][C:24](=[O:25])[CH3:26].[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:16][cH:17][cH:18][cH:19]2)[S:6][c:7]2[c:8]1[cH:9][cH:10][c:11]([C:13](=[O:14])[OH:15])[cH:12]2.[O:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1.[OH2:32]>>[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:16][cH:17][cH:18][cH:19]2)[S:6][c:7]2[c:8]1[cH:9][cH:10][c:11]([CH2:13][OH:14])[cH:12]2참가 물질
6
출처 및 근거
- ORD 기록
- ord-19809f95087e4d6d8d98c80976c85ad9
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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