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[CH:14]([CH3:15])([CH3:16])[NH:17][C:18]([CH2:19][C:20]#[N:21])=[O:22].[OH:1][c:2]1[cH:3][c:4]([CH:5]=[O:6])[cH:7][c:8]([N+:11](=[O:12])[O-:13])[c:9]1[OH:10]>>[OH:1][c:2]1[cH:3][c:4]([CH:5]=[C:19]([C:18]([NH:17][CH:14]([CH3:15])[CH3:16])=[O:22])[C:20]#[N:21])[cH:7][c:8]([N+:11](=[O:12])[O-:13])[c:9]1[OH:10]참가 물질
3
출처 및 근거
- ORD 기록
- ord-58d959285c5c4a35a444480c85320298
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…