Methyl 2'-methoxy-5'-methyl-4-nitro-2-biphenylcarboxylate → 2'-Methoxy-5'-methyl-4-nitro-2-biphenylcarboxylic acid
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[CH3:22][O:23][c:24]1[c:25](-[c:31]2[c:32]([C:40](=[O:41])[O:42][CH3:43])[cH:33][c:34]([N+:37](=[O:38])[O-:39])[cH:35][cH:36]2)[cH:26][c:27]([CH3:30])[cH:28][cH:29]1.[F:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH3:7])[c:8](-[c:9]2[c:10]([C:11]([OH:12])=[O:13])[cH:14][c:15]([N+:16]([O-:17])=[O:18])[cH:19][cH:20]2)[cH:21]1>>[CH3:22][O:23][c:24]1[c:25](-[c:31]2[c:32]([C:40](=[O:41])[OH:42])[cH:33][c:34]([N+:37](=[O:38])[O-:39])[cH:35][cH:36]2)[cH:26][c:27]([CH3:30])[cH:28][cH:29]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-d0c45549a1504eefac66c296b42dc045
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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