Acetic Acid → 5-Methyl-2-oxo-1,2-dihydro-1,6-naphthyridine-3-carboxylic acid
반응식
[CH3:1][c:2]1[c:3]2[cH:4][c:5]([C:13]#[N:14])[c:6](=[O:12])[nH:7][c:8]2[cH:9][cH:10][n:11]1.[CH3:23][C:24](=[O:25])[OH:26].[CH3:27][OH:28].[NH4+:21].[OH-:22].[OH2:20].[S:15](=[O:16])(=[O:17])([OH:18])[OH:19]>>[CH3:1][c:2]1[c:3]2[cH:4][c:5]([C:13](=[O:20])[OH:22])[c:6](=[O:12])[nH:7][c:8]2[cH:9][cH:10][n:11]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-139ec007e12a42b790b4fc52d745503c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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