Sodium Ion → 4-(4-ethyl-1-methyl-1H-pyrazol-5-yl)-5-methyl-2-thiophenecarboxylic acid
반응식
[CH2:1]([CH3:2])[c:3]1[cH:4][n:5][n:6]([CH3:18])[c:7]1-[c:8]1[cH:9][c:10]([C:14](=[O:15])[O:16][CH3:17])[s:11][c:12]1[CH3:13].[Na+:20].[O:21]1[CH2:22][CH2:23][CH2:24][CH2:25]1.[OH-:19]>>[CH2:1]([CH3:2])[c:3]1[cH:4][n:5][n:6]([CH3:18])[c:7]1-[c:8]1[cH:9][c:10]([C:14](=[O:15])[OH:16])[s:11][c:12]1[CH3:13]참가 물질
5
출처 및 근거
- ORD 기록
- ord-8bed21c18f54494e9330c6d262b8b6bf
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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