Methanol → HCID 10047672, 화합물
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[CH3:32][OH:33].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[c:11](=[O:26])[c:12]3[c:13]([n:14]([CH2:16][CH3:17])[cH:15]2)[s:18][c:19]([C:21]#[C:22][CH2:23][CH2:24][OH:25])[cH:20]3)[cH:27][cH:28]1.[Cl:29][CH2:30][Cl:31]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[c:11](=[O:26])[c:12]3[c:13]([n:14]([CH2:16][CH3:17])[cH:15]2)[s:18][c:19]([CH2:21][CH2:22][CH2:23][CH2:24][OH:25])[cH:20]3)[cH:27][cH:28]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-708cc2cc7bf44adeb50ae0fa4c6af72a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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