HRID168690

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID80908

Ethyl N-(phenylmethyl)glycinate

C11H15NO2

结构：CCC(C)C(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

HCID100103

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CN(Cc1ccccc1)C(=O)C(NC(=O)OCC1c2ccccc2-c2ccccc21)C(C)CC

HCID18460608

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-00a3386c49274ed88c7be8e4951e3535
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:27]([CH3:28])[O:29][C:30]([CH2:31][NH:32][CH2:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1)=[O:40].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:13]1[CH:12]([CH2:14][O:15][C:16](=[O:17])[NH:18][CH:19]([CH:20]([CH3:21])[CH2:22][CH3:23])[C:24](=[O:25])[OH:26])[c:11]1[c:6]-2[cH:7][cH:8][cH:9][cH:10]1>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:13]1[CH:12]([CH2:14][O:15][C:16](=[O:17])[NH:18][CH:19]([CH:20]([CH3:21])[CH2:22][CH3:23])[C:24](=[O:25])[N:32]([CH2:31][C:30]([O:29][CH2:27][CH3:28])=[O:40])[CH2:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1)[c:11]1[c:6]-2[cH:7][cH:8][cH:9][cH:10]1