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[CH3:15][c:16]1[c:17]([NH:23][C:24]([CH2:25][Cl:26])=[O:27])[c:18]([CH3:22])[cH:19][cH:20][cH:21]1.[CH3:35][N:36]([CH3:37])[CH:38]=[O:39].[NH:1]1[CH2:2][CH2:3][CH:4]([c:7]2[c:8]([C:9]#[N:10])[cH:11][cH:12][cH:13][n:14]2)[CH2:5][CH2:6]1.[Na+:28].[Na+:29].[O-:30][C:31](=[O:32])[O-:33].[OH2:34]>>[N:1]1([CH2:25][C:24]([NH:23][c:17]2[c:16]([CH3:15])[cH:21][cH:20][cH:19][c:18]2[CH3:22])=[O:27])[CH2:2][CH2:3][CH:4]([c:7]2[c:8]([C:9]#[N:10])[cH:11][cH:12][cH:13][n:14]2)[CH2:5][CH2:6]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-347a251c4930440f9489a2d8240a1500
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…