Sodium ion → 3-[4-(4-Methylphenyl)thiophen-2-yl]prop-2-enoic acid
반응식
[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([CH:13]=[CH:14][C:15](=[O:16])[O:17][CH3:18])[s:11][cH:12]2)[cH:6][cH:7]1.[Na+:20].[O:21]1[CH2:22][CH2:23][CH2:24][CH2:25]1.[OH-:19]>>[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([CH:13]=[CH:14][C:15](=[O:16])[OH:17])[s:11][cH:12]2)[cH:6][cH:7]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-68a7dbbab65146058ed03906a64af445
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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