반응식
[Br:1][CH2:2][CH:3]1[CH2:4][O:5][c:6]2[c:7]([cH:9][cH:10][cH:11][cH:12]2)[O:8]1.[CH3:13][O:14][c:15]1[cH:16][c:17]([CH:21]2[CH2:22][NH:23][CH2:24][CH2:25][CH2:26]2)[cH:18][cH:19][cH:20]1.[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[CH3:35][C:36]#[N:37].[ClH:27]>>[CH2:2]([CH:3]1[CH2:4][O:5][c:6]2[c:7]([cH:9][cH:10][cH:11][cH:12]2)[O:8]1)[N:23]1[CH2:22][CH:21]([c:17]2[cH:16][c:15]([O:14][CH3:13])[cH:20][cH:19][cH:18]2)[CH2:26][CH2:25][CH2:24]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-e5dbe47147774431a9a5fd7acd5dd0a4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…