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[CH3:12][O:13][C:14]([c:15]1[cH:16][c:17]([NH2:23])[c:18]([O:21][CH3:22])[cH:19][cH:20]1)=[O:24].[Cl:25][c:26]1[cH:27][c:28]([C:29]#[N:30])[cH:31][cH:32][c:33]1[F:34].[Na+:39].[O-:35][C:36]([OH:37])=[O:38].[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1>>[CH3:12][O:13][C:14]([c:15]1[cH:16][c:17]([NH:23][C:29]([c:28]2[cH:27][c:26]([Cl:25])[c:33]([F:34])[cH:32][cH:31]2)=[NH:30])[c:18]([O:21][CH3:22])[cH:19][cH:20]1)=[O:24]참가 물질
6
출처 및 근거
- ORD 기록
- ord-52d7fd09a7774991853134bbed7f448d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…