반응식
[CH3:1][N:2]([c:3]1[c:4]([CH2:10][C:11](=[O:12])[OH:13])[c:5]([F:9])[cH:6][cH:7][cH:8]1)[CH3:14].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[Cl:45][CH2:46][Cl:47].[ClH:15].[c:16]1([C:22]2([c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[CH2:23][CH2:24][C:25](=[O:31])[CH:26]3[CH2:27][NH:28][CH2:29][CH:30]23)[cH:17][cH:18][cH:19][cH:20][cH:21]1>>[CH3:1][N:2]([c:3]1[c:4]([CH2:10][C:11](=[O:13])[N:28]2[CH2:27][CH:26]3[C:25](=[O:31])[CH2:24][CH2:23][C:22]([c:16]4[cH:17][cH:18][cH:19][cH:20][cH:21]4)([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[CH:30]3[CH2:29]2)[c:5]([F:9])[cH:6][cH:7][cH:8]1)[CH3:14]참가 물질
6
출처 및 근거
- ORD 기록
- ord-ecbcf947e7674d6882da469b9c71671c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…