Sodium Ion → 5-Hydroxy-2-methylbenzoic acid
반응식
[N:17]([O-:18])=[O:19].[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH3:11])[c:6]([C:7](=[O:8])[OH:9])[cH:10]1.[Na+:20].[OH2:21].[S:12]([OH:13])(=[O:14])(=[O:15])[OH:16]>>[c:2]1([OH:13])[cH:3][cH:4][c:5]([CH3:11])[c:6]([C:7](=[O:8])[OH:9])[cH:10]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-f149e1d192cb4d36b718b44c0999b0c5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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