Benzene → HCID 54019979, 화합물
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[CH3:28][CH2:29][O:30][CH2:31][CH3:32].[Cl:24][C:25]([Cl:26])=[O:27].[F:1][C:2]([C:3]([C:4]([F:5])([F:6])[F:7])([OH:8])[c:9]1[cH:10][cH:11][c:12]([NH:13][CH3:14])[cH:15][cH:16]1)([F:17])[F:18].[Na+:23].[O-:19][C:20]([OH:21])=[O:22].[OH2:33].[cH:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[F:1][C:2]([C:3]([C:4]([F:5])([F:6])[F:7])([OH:8])[c:9]1[cH:10][cH:11][c:12]([N:13]([CH3:14])[C:25]([Cl:24])=[O:27])[cH:15][cH:16]1)([F:17])[F:18]참가 물질
8
출처 및 근거
- ORD 기록
- ord-3f8d12daa90d42fa9e1151aab2982235
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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