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[CH3:28][C:29]([C:30](=[O:31])[OH:32])([CH2:33][CH2:34][CH2:35][CH3:36])[CH3:37].[CH:48]([N:49]([CH2:50][CH3:51])[CH:52]([CH3:53])[CH3:54])([CH3:55])[CH3:56].[Cl:57][CH2:58][Cl:59].[NH2:1][CH2:2][CH:3]([CH:4]([CH2:5][CH:6]([CH:7]([CH3:8])[CH3:9])[CH2:10][O:11][CH2:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[NH:19][C:20]([O:21][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26])[OH:27].[OH:38][n:39]1[c:40]2[c:41]([cH:42][cH:43][cH:44][cH:45]2)[n:46][n:47]1>>[NH:1]([CH2:2][CH:3]([CH:4]([CH2:5][CH:6]([CH:7]([CH3:8])[CH3:9])[CH2:10][O:11][CH2:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[NH:19][C:20]([O:21][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26])[OH:27])[C:30]([C:29]([CH3:28])([CH2:33][CH2:34][CH2:35][CH3:36])[CH3:37])=[O:31]참가 물질
6
출처 및 근거
- ORD 기록
- ord-eb4c75d67147418797b476be27203627
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
연결된 노트
불러오는 중…