반응식
[Al+3:36].[CH3:16][c:17]1[nH:18][cH:19][cH:20][n:21]1.[CH3:1][n:2]1[c:3]2[cH:4][cH:5][cH:6][cH:7][c:8]2[c:9]2[c:14]1[CH2:13][CH2:12][CH2:11][C:10]2=[O:15].[CH3:41][C:42]#[N:43].[Cl-:35].[Cl-:37].[Cl-:38].[Cl:44][CH2:45][Cl:46].[N:22]1([CH2:24][N:25]2[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]2)[CH2:23][CH2:34][CH2:33][CH2:32][CH2:31]1.[Na+:40].[OH-:39]>>[CH3:1][n:2]1[c:3]2[cH:4][cH:5][cH:6][cH:7][c:8]2[c:9]2[c:14]1[CH2:13][CH2:12][CH:11]([CH2:23][n:18]1[c:17]([CH3:16])[n:21][cH:20][cH:19]1)[C:10]2=[O:15]참가 물질
10
출처 및 근거
- ORD 기록
- ord-26bfaacb21064129940967a14b780328
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
연결된 노트
불러오는 중…