Methanol → 3,5-dimethyl-4-(2-trifluoromethyl-phenyl)-1H-pyrrole-2-carboxylic acid
반응식
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[nH:7][c:8]([CH3:22])[c:9](-[c:12]2[c:13]([C:18]([F:19])([F:20])[F:21])[cH:14][cH:15][cH:16][cH:17]2)[c:10]1[CH3:11].[CH3:25][OH:26].[Na+:24].[OH-:23]>>[O:3]=[C:4]([OH:5])[c:6]1[nH:7][c:8]([CH3:22])[c:9](-[c:12]2[c:13]([C:18]([F:19])([F:20])[F:21])[cH:14][cH:15][cH:16][cH:17]2)[c:10]1[CH3:11]참가 물질
5
출처 및 근거
- ORD 기록
- ord-3c633bf6d3a2445e8960d662a874a597
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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