Ethanol → HCID 18507672, 화합물
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[CH2:17]([CH2:18][CH2:19][CH3:20])[Br:21].[CH3:22][CH2:23][OH:24].[NH2:1][c:2]1[nH:3][c:4](=[S:16])[c:5]([C:14]#[N:15])[c:6](-[c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[n:7]1>>[NH2:1][c:2]1[n:3][c:4]([S:16][CH2:17][CH2:18][CH2:19][CH3:20])[c:5]([C:14]#[N:15])[c:6](-[c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[n:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-855063bee4834a00b7e2fddada667b97
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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