tert-Butanol → HCID 178480598, 화합물
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[C:25]([OH:26])([CH3:27])([CH3:28])[CH3:29].[CH2:19]1[CH2:20][O:21][CH2:22][CH2:23][NH:24]1.[CH3:2][n:3]1[c:4]([NH:8][C:9](=[N:10][c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[S:17][CH3:18])[n:5][cH:6][cH:7]1.[IH:1]>>[CH3:2][n:3]1[c:4]([NH:8][C:9](=[N:10][c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[N:24]2[CH2:19][CH2:20][O:21][CH2:22][CH2:23]2)[n:5][cH:6][cH:7]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-133b9079db9942d5abe5e173375e915f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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