HRID1535731

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

HCID6212

Chloroform

CHCl3

HCID519419

ethyl (2S)-2-amino-3-methylbutanoate

C7H15NO2

结构：CC(NC(=O)Cc1cccc([N+](=O)[O-])c1)C(=O)NC(C(=O)O)C(C)O

HCID178465022

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(NC(=O)C(NC(=O)C(C)NC(=O)Cc1cccc([N+](=O)[O-])c1)C(C)O)C(C)C

HCID178472808

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d8a6789730014a48ac06dd5d1d7d6834
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH2:27]([CH3:28])[O:29][C:30]([CH:31]([NH2:32])[CH:33]([CH3:34])[CH3:35])=[O:36].[CH3:41][OH:42].[Cl:37][CH:38]([Cl:39])[Cl:40].[ClH:26].[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])[NH:18][CH:19]([CH:20]([OH:21])[CH3:22])[C:23](=[O:24])[OH:25])[cH:7][cH:8][cH:9]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:17])[NH:18][CH:19]([CH:20]([OH:21])[CH3:22])[C:23](=[O:25])[NH:32][CH:31]([C:30]([O:29][CH2:27][CH3:28])=[O:36])[CH:33]([CH3:34])[CH3:35])[cH:7][cH:8][cH:9]1