Methanol → HCID 178452675, 화합물
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[CH3:28][OH:29].[F:4][c:5]1[c:6]([CH:12]2[CH2:13][CH2:14][CH:15]([NH:20][C:21]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[C:16](=[S:19])[NH:17][CH2:18]2)[cH:7][cH:8][cH:9][c:10]1[F:11].[NH2:2][NH2:3].[OH2:1]>>[N:2]([NH2:3])=[C:16]1[CH:15]([NH:20][C:21]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[CH2:14][CH2:13][CH:12]([c:6]2[c:5]([F:4])[c:10]([F:11])[cH:9][cH:8][cH:7]2)[CH2:18][NH:17]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-c33ffa92d3804579ba3320980de48c92
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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