Sodium Ion → 4-(Ethoxycarbonylamino)-thiophene-3-carboxaldehyde
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[Al+3:2].[C:25]([O:26][CH3:27])([CH3:28])([CH3:29])[CH3:30].[CH2:7]([CH3:8])[O:9][C:10](=[O:11])[NH:12][c:13]1[c:14]([C:18](=[O:19])[O:20][CH3:21])[cH:15][s:16][cH:17]1.[H-:1].[H-:4].[H-:5].[H-:6].[Li+:3].[Na+:24].[OH-:23].[OH2:22]>>[CH2:7]([CH3:8])[O:9][C:10](=[O:11])[NH:12][c:13]1[c:14]([CH:18]=[O:19])[cH:15][s:16][cH:17]1참가 물질
9
출처 및 근거
- ORD 기록
- ord-cc1b00c6e37745bbb41ee7b4ac97af7b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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