Pyridine → SB 203347
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[CH:22]([OH:23])([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[F:36][C:37]([c:38]1[cH:39][c:40]([S:48](=[O:49])(=[O:50])[Cl:51])[cH:41][c:42]([C:44]([F:45])([F:46])[F:47])[cH:43]1)([F:52])[F:53].[NH2:1][c:2]1[c:3]([O:4][c:5]2[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12][cH:13]2)[cH:14][cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]1.[cH:54]1[cH:55][cH:56][n:57][cH:58][cH:59]1>>[NH:1]([c:2]1[c:3]([O:4][c:5]2[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12][cH:13]2)[cH:14][cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]1)[S:48]([c:40]1[cH:39][c:38]([C:37]([F:36])([F:52])[F:53])[cH:43][c:42]([C:44]([F:45])([F:46])[F:47])[cH:41]1)(=[O:49])=[O:50]참가 물질
5
출처 및 근거
- ORD 기록
- ord-c3eb0c4c95304abca5a649b85661eb7f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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