Methanol → 4-[N-(4-Fluoro-2-trifluoromethylphenyl)sulfamoyl]-benzoic acid-(2,3,4-trihydroxy-butyl)-amide
반응식
[CH3:36][OH:37].[OH2:35].[OH:1][CH:2]([CH2:3][NH:4][C:5]([c:6]1[cH:7][cH:8][c:9]([S:12]([NH:13][c:14]2[c:15]([C:21]([F:22])([F:23])[F:24])[cH:16][c:17]([F:20])[cH:18][cH:19]2)(=[O:25])=[O:26])[cH:10][cH:11]1)=[O:27])[CH:28]1[O:29][C:30]([CH3:33])([CH3:34])[O:31][CH2:32]1>>[OH:1][CH:2]([CH2:3][NH:4][C:5]([c:6]1[cH:7][cH:8][c:9]([S:12]([NH:13][c:14]2[c:15]([C:21]([F:22])([F:23])[F:24])[cH:16][c:17]([F:20])[cH:18][cH:19]2)(=[O:25])=[O:26])[cH:10][cH:11]1)=[O:27])[CH:28]([OH:29])[CH2:32][OH:31]참가 물질
4
출처 및 근거
- ORD 기록
- ord-83b99625e7eb4b00bdd995179aee82d8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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