Acetic Acid → 6-[4-(Acetylamino)phenyl]-1,2-dihydro-2-oxonicotinic acid
반응식
[CH3:18][C:19](=[O:20])[O:21][C:22](=[O:23])[CH3:24].[CH3:25][C:26](=[O:27])[OH:28].[NH2:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[nH:9][c:10](=[O:17])[c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16]2)[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5](-[c:8]2[nH:9][c:10](=[O:17])[c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16]2)[cH:6][cH:7]1)[C:19]([CH3:18])=[O:20]참가 물질
4
출처 및 근거
- ORD 기록
- ord-804a9c9b04824a77a5d0b21f5e846f45
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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