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[Cl:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][cH:7][c:8]([F:12])[c:9]1[C:10]#[N:11].[Li+:23].[Li+:24].[O-:25][C:26](=[O:27])[O-:28].[OH:13][C:14]([CH3:15])([CH3:16])[CH:17]1[CH:18]([CH3:22])[NH:19][CH2:20][CH2:21]1>>[Cl:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][cH:7][c:8]([N:19]2[CH:18]([CH3:22])[CH:17]([C:14]([OH:13])([CH3:15])[CH3:16])[CH2:21][CH2:20]2)[c:9]1[C:10]#[N:11]참가 물질
5
출처 및 근거
- ORD 기록
- ord-adb030e6267b4d8a942507014652a16d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…