반응식
[CH3:12][N:13]1[CH2:14][CH2:15][N:16]([c:19]2[s:20][cH:21][c:22](-[c:24]3[cH:25][cH:26][c:27]([C:30]4=[N:31][C:32]5([C:33](=[O:35])[O:34]4)[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]5)[cH:28][cH:29]3)[n:23]2)[CH2:17][CH2:18]1.[CH3:2][O:3][C:4]([CH:5]([NH2:6])[CH2:7][CH2:8][S:9][CH3:10])=[O:11].[CH3:50][N:51]([CH3:52])[CH:53]=[O:54].[CH:41]([N:42]([CH2:43][CH3:44])[CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[ClH:1]>>[CH3:2][O:3][C:4]([CH:5]([NH:6][C:33]([C:32]1([NH:31][C:30]([c:27]2[cH:26][cH:25][c:24](-[c:22]3[cH:21][s:20][c:19]([N:16]4[CH2:15][CH2:14][N:13]([CH3:12])[CH2:18][CH2:17]4)[n:23]3)[cH:29][cH:28]2)=[O:34])[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]1)=[O:35])[CH2:7][CH2:8][S:9][CH3:10])=[O:11]참가 물질
6
출처 및 근거
- ORD 기록
- ord-c7c1382eb7c6417eb086ee0e7b0c62df
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…