Ethanol → HCID 21557438, 화합물
반응식
[CH3:16][N:17]1[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]1.[CH3:23][CH2:24][OH:25].[Cl:1][c:2]1[n:3][c:4](-[c:9]2[cH:10][c:11]([Cl:15])[cH:12][cH:13][cH:14]2)[n:5][c:6]([Cl:8])[cH:7]1>>[c:2]1([N:20]2[CH2:19][CH2:18][N:17]([CH3:16])[CH2:22][CH2:21]2)[n:3][c:4](-[c:9]2[cH:10][c:11]([Cl:15])[cH:12][cH:13][cH:14]2)[n:5][c:6]([Cl:8])[cH:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-524c4de18f454e7d9a589b6b3778122a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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