Hydrochloric Acid → Hydrochloric Acid
반응식
[C:1]([O:2][C:3](=[O:4])[N:8]([CH:9]([CH3:10])[c:11]1[cH:12][cH:13][cH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12)[CH2:21][CH:22]1[CH:23]([c:40]2[cH:41][c:42]([F:46])[cH:43][cH:44][cH:45]2)[CH2:24][N:25]([C:28](=[O:29])[O:30][c:31]2[cH:32][c:33]([C:34](=[O:35])[OH:36])[cH:37][cH:38][cH:39]2)[CH2:26][CH2:27]1)([CH3:5])([CH3:6])[CH3:7].[C:47]([O:48][CH2:49][CH3:50])(=[O:51])[CH3:52].[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[ClH:53]>>[ClH:53].[NH:8]([CH:9]([CH3:10])[c:11]1[cH:12][cH:13][cH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12)[CH2:21][CH:22]1[CH:23]([c:40]2[cH:41][c:42]([F:46])[cH:43][cH:44][cH:45]2)[CH2:24][N:25]([C:28](=[O:29])[O:30][c:31]2[cH:32][c:33]([C:34](=[O:35])[OH:36])[cH:37][cH:38][cH:39]2)[CH2:26][CH2:27]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-e290b1c7c9dc49c58e48f435964c66c9
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)