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[Br:1][c:2]1[cH:3][c:4]([F:23])[cH:5][c:6]2[c:7]([CH2:15][c:16]3[cH:17][c:18]([F:22])[cH:19][cH:20][cH:21]3)[c:8]([S:11](=[O:12])(=[O:13])[Cl:14])[o:9][c:10]12.[C:30](=[O:31])([OH:32])[O-:33].[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:35][I:36].[Na+:28].[Na+:29].[Na+:34].[OH2:42].[S:24]([O-:25])([O-:26])=[O:27]>>[Br:1][c:2]1[cH:3][c:4]([F:23])[cH:5][c:6]2[c:7]([CH2:15][c:16]3[cH:17][c:18]([F:22])[cH:19][cH:20][cH:21]3)[c:8]([S:11](=[O:12])(=[O:13])[CH3:30])[o:9][c:10]12참가 물질
8
출처 및 근거
- ORD 기록
- ord-b2517afacd3140a5a76c4a829d2228d2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
연결된 노트
불러오는 중…