3-Methoxy-4-hydroxy-5-nitrocinnamaldehyde → 2-cyano-N-[(3,4-dihydroxyphenyl)methyl]-5-(4-hydroxy-3-methoxy-5-nitrophenyl)penta-2,4-dienamide
반응식
[C:17](#[N:18])[CH2:19][C:20](=[O:21])[N-:22][CH2:23][c:24]1[cH:25][c:26]([OH:31])[c:27]([OH:30])[cH:28][cH:29]1.[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:6]=[CH:7][CH:8]=[O:9])[cH:10][c:11]([N+:14](=[O:15])[O-:16])[c:12]1[OH:13]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:6]=[CH:7][CH:8]=[C:19]([C:17]#[N:18])[C:20](=[O:21])[NH:22][CH2:23][c:24]2[cH:25][c:26]([OH:31])[c:27]([OH:30])[cH:28][cH:29]2)[cH:10][c:11]([N+:14](=[O:15])[O-:16])[c:12]1[OH:13]참가 물질
3
출처 및 근거
- ORD 기록
- ord-fcc7c3cf9a9c462789825e26bc37395b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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