Ethanol → HCID 10774329, 화합물
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[CH3:15][NH2:16].[CH3:21][OH:22].[CH3:23][CH2:24][OH:25].[Cl:18][CH2:19][Cl:20].[Cl:1][c:2]1[c:3]2[n:4]([c:5]3[cH:6][cH:7][cH:8][cH:9][c:10]3[n:11]1)[cH:12][cH:13][n:14]2.[Cl:26][CH2:27][Cl:28].[OH2:17]>>[c:2]1([NH:16][CH3:15])[c:3]2[n:4]([c:5]3[cH:6][cH:7][cH:8][cH:9][c:10]3[n:11]1)[cH:12][cH:13][n:14]2참가 물질
7
출처 및 근거
- ORD 기록
- ord-240eb0945f7e4a289a03d66252da0a3a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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