HRID90488

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID27099

Copper(2+)

Cu+2

HCID66827

Boronic acid, phenyl-

C6H7BO2

结构：COc1ccc(NCCNC(=O)C(Cc2ccc(O)cc2)NC(=O)c2cccc(C)c2)cc1

HCID21055509

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(NCCNC(=O)C(Cc2ccc(Oc3ccccc3)cc2)NC(=O)c2cccc(C)c2)cc1

HCID21950683

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f152d248d3af4689ba4d84c9b07b4825
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:46]([O-:47])(=[O:48])[CH3:49].[C:51]([O-:52])(=[O:53])[CH3:54].[Cl:43][CH2:44][Cl:45].[Cu+2:50].[OH:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH:9]([C:10]([NH:11][CH2:12][CH2:13][NH:14][c:15]2[cH:16][cH:17][c:18]([O:21][CH3:22])[cH:19][cH:20]2)=[O:23])[NH:24][C:25]([c:26]2[cH:27][c:28]([CH3:32])[cH:29][cH:30][cH:31]2)=[O:33])[cH:6][cH:7]1.[c:34]1([B:40]([OH:41])[OH:42])[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[O:1]([c:2]1[cH:3][cH:4][c:5]([CH2:8][CH:9]([C:10]([NH:11][CH2:12][CH2:13][NH:14][c:15]2[cH:16][cH:17][c:18]([O:21][CH3:22])[cH:19][cH:20]2)=[O:23])[NH:24][C:25]([c:26]2[cH:27][c:28]([CH3:32])[cH:29][cH:30][cH:31]2)=[O:33])[cH:6][cH:7]1)[c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1