Methyl 4-aminobutanoate → methyl N-[N-(3,4,5-trimethoxybenzoyl)-4-(2,6-dimethylanilino)butyryl]-4-aminobutyrate
반응식
[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]([c:9]2[c:10]([CH3:16])[cH:11][cH:12][cH:13][c:14]2[CH3:15])[CH2:17][CH2:18][CH2:19][C:20](=[O:21])[OH:22])[cH:23][c:24]([O:28][CH3:29])[c:25]1[O:26][CH3:27].[NH2:30][CH2:31][CH2:32][CH2:33][C:34](=[O:35])[O:36][CH3:37]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]([c:9]2[c:10]([CH3:16])[cH:11][cH:12][cH:13][c:14]2[CH3:15])[CH2:17][CH2:18][CH2:19][C:20](=[O:21])[NH:30][CH2:31][CH2:32][CH2:33][C:34](=[O:35])[O:36][CH3:37])[cH:23][c:24]([O:28][CH3:29])[c:25]1[O:26][CH3:27]참가 물질
3
출처 및 근거
- ORD 기록
- ord-a8380c5d497f4bafa0cf118d6defff9f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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