Ethyl Acetate → methyl 3-(3-hydroxyphenyl)-2-[2-[[2-(3-nitrophenyl)acetyl]amino]propanoylamino]propanoate
반응식
[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH2:10][C:11](=[O:12])[NH:13][CH:14]([CH3:15])[C:16](=[O:17])[OH:18])[cH:7][cH:8][cH:9]1.[NH2:19][CH:20]([C:21](=[O:22])[O:23][CH3:24])[CH2:25][c:26]1[cH:27][c:28]([OH:32])[cH:29][cH:30][cH:31]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH2:10][C:11](=[O:12])[NH:13][CH:14]([CH3:15])[C:16](=[O:18])[NH:19][CH:20]([C:21](=[O:22])[O:23][CH3:24])[CH2:25][c:26]2[cH:27][c:28]([OH:32])[cH:29][cH:30][cH:31]2)[cH:7][cH:8][cH:9]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-7467acb2a8434c15b48f4435c7701505
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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