Acetate → HCID 66954743, 화합물
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[Br:1][c:2]1[c:3]([F:14])[cH:4][n:5][c:6]2[cH:7][cH:8][c:9]([O:12][CH3:13])[n:10][c:11]12.[CH2:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[O:30][C:31]([NH:32][CH:33]1[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]1)=[O:39].[K+:20].[K+:21].[K+:22].[O-:41][C:42]([CH3:43])=[O:44].[O-:45][C:46]([CH3:47])=[O:48].[P:15]([O-:16])([O-:17])([O-:18])=[O:19].[Pd+2:40]>>[c:2]1([N:36]2[CH2:35][CH2:34][CH:33]([NH:32][C:31]([O:30][CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)=[O:39])[CH2:38][CH2:37]2)[c:3]([F:14])[cH:4][n:5][c:6]2[cH:7][cH:8][c:9]([O:12][CH3:13])[n:10][c:11]12참가 물질
7
출처 및 근거
- ORD 기록
- ord-55e9c4468b334bc2a95cdaf33e3471f9
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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