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[CH3:31][N:32]1[CH2:33][CH2:34][CH2:35][C:36]1=[O:37].[Cl:1][c:2]1[cH:3][c:4]2[c:5]3[c:6]([nH:7][c:8]2[cH:9][cH:10]1)[CH2:11][CH2:12][N:13]([CH3:15])[CH2:14]3.[F:16][C:17]([n:18]1[c:19](=[O:26])[cH:20][cH:21][c:22]([CH:24]=[CH2:25])[cH:23]1)([F:27])[F:28].[K+:30].[OH-:29]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]3[c:6]([n:7]([CH2:25][CH2:24][c:22]4[cH:21][cH:20][c:19](=[O:26])[n:18]([C:17]([F:16])([F:27])[F:28])[cH:23]4)[c:8]2[cH:9][cH:10]1)[CH2:11][CH2:12][N:13]([CH3:15])[CH2:14]3참가 물질
6
출처 및 근거
- ORD 기록
- ord-41ec7d59ef3e44c3a56b73356f682fe2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…