반응식
[C:1](=[O:2])([CH3:3])[O:4][CH2:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[cH:15][c:16](-[c:23]3[c:24]([CH2:33][N:34]4[C:35](=[O:54])[O:36][CH:37]([c:40]5[cH:41][c:42]([C:50]([F:51])([F:52])[F:53])[cH:43][c:44]([C:46]([F:47])([F:48])[F:49])[cH:45]5)[CH:38]4[CH3:39])[cH:25][c:26]([C:29]([F:30])([F:31])[F:32])[cH:27][cH:28]3)[c:17]([O:21][CH3:22])[cH:18][c:19]2[F:20])[CH2:12][CH2:13]1.[CH3:55][O-:56].[CH3:59][OH:60].[Na+:57].[OH2:58]>>[OH:4][CH2:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[cH:15][c:16](-[c:23]3[c:24]([CH2:33][N:34]4[C:35](=[O:54])[O:36][CH:37]([c:40]5[cH:41][c:42]([C:50]([F:51])([F:52])[F:53])[cH:43][c:44]([C:46]([F:47])([F:48])[F:49])[cH:45]5)[CH:38]4[CH3:39])[cH:25][c:26]([C:29]([F:30])([F:31])[F:32])[cH:27][cH:28]3)[c:17]([O:21][CH3:22])[cH:18][c:19]2[F:20])[CH2:12][CH2:13]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-e638f267a0b84752932410a59eb789ab
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
연결된 노트
불러오는 중…