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[C:17]([CH3:18])(=[O:19])[O:20][c:21]1[cH:22][cH:23][c:24]([Br:27])[cH:25][cH:26]1.[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]([CH:8]=[CH2:9])[cH:10][c:11]([O:13][C:14]([CH3:15])=[O:16])[cH:12]1.[CH2:34]([N+:35]([CH2:36][CH2:37][CH2:38][CH3:39])([CH2:40][CH2:41][CH2:42][CH3:43])[CH2:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH2:49][CH3:50].[Cl-:33].[Na+:32].[O-:28][C:29]([OH:30])=[O:31].[O:51]=[CH:52][N:53]([CH3:54])[CH3:55]>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]([CH:8]=[CH:9][c:24]2[cH:23][cH:22][c:21]([O:20][C:17]([CH3:18])=[O:19])[cH:26][cH:25]2)[cH:10][c:11]([O:13][C:14]([CH3:15])=[O:16])[cH:12]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-ea9d51901b9e4d09b0fe1eb22adc495c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
연결된 노트
불러오는 중…