Dimethyl Sulfoxide → HCID 72272699, 화합물
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[CH3:25][S:26]([CH3:27])=[O:28].[Cl:8][c:9]1[c:10]([C:11]#[N:12])[cH:13][cH:14][c:15]([F:18])[c:16]1[CH3:17].[Li+:19].[Li+:20].[O-:21][C:22](=[O:23])[O-:24].[OH:1][CH:2]1[CH:3]([CH3:7])[NH:4][CH2:5][CH2:6]1>>[OH:1][CH:2]1[CH:3]([CH3:7])[N:4]([c:15]2[cH:14][cH:13][c:10]([C:11]#[N:12])[c:9]([Cl:8])[c:16]2[CH3:17])[CH2:5][CH2:6]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-c698f37878ef46ec810cc3117ce7c7ac
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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