반응식
[CH2:16]([CH2:17][CH3:18])[O:19][CH:20]1[CH2:21][CH2:22][CH:23]([N:26]2[CH2:27][CH2:28][CH:29]([NH2:32])[CH2:30][CH2:31]2)[CH2:24][CH2:25]1.[CH3:42][N:43]([CH3:44])[CH:45]=[O:46].[CH:1]1([c:4]2[cH:5][c:6]([F:13])[c:7]([N+:10](=[O:11])[O-:12])[cH:8][cH:9]2)[CH2:2][CH2:3]1.[CH:33]([N:34]([CH:35]([CH3:36])[CH3:37])[CH2:38][CH3:39])([CH3:40])[CH3:41].[ClH:14].[ClH:15]>>[CH:1]1([c:4]2[cH:5][c:6]([NH:32][CH:29]3[CH2:28][CH2:27][N:26]([CH:23]4[CH2:22][CH2:21][CH:20]([O:19][CH2:16][CH2:17][CH3:18])[CH2:25][CH2:24]4)[CH2:31][CH2:30]3)[c:7]([N+:10](=[O:11])[O-:12])[cH:8][cH:9]2)[CH2:2][CH2:3]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-d2b86cf3bb774fa78da16dc11c679372
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…