Ethanol → HCID 20156411, 화합물
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[B:22]([Br:23])([Br:24])[Br:25].[CH2:29]([Cl:30])[Cl:31].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:13]2[n:14][c:15]3[n:16]([cH:17][cH:18][cH:19][n:20]3)[cH:21]2)[c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12.[CH3:26][CH2:27][OH:28]>>[OH:2][c:3]1[cH:4][cH:5][c:6](-[c:13]2[n:14][c:15]3[n:16]([cH:17][cH:18][cH:19][n:20]3)[cH:21]2)[c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12참가 물질
5
출처 및 근거
- ORD 기록
- ord-d3e665c91d604281b28fcb14d31d05eb
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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