HRID2162570

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID4574913

未命名化合物

HCID19036294

未命名化合物

HCID178440079

未命名化合物

PRODUCTS

生成物

结构：CCCc1nc(C(C)(C)O)c(C(=O)OCC)n1Cc1ccc(-c2ccccc2C(=O)NC(C)(C)C)cc1

HCID19036152

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-26c8d51a8aa04287b4563ac213ba8474
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:18]([CH3:19])([CH3:20])([CH3:21])[NH:22][C:23](=[O:24])[c:25]1[c:26](-[c:31]2[cH:32][cH:33][c:34]([CH2:37][Br:38])[cH:35][cH:36]2)[cH:27][cH:28][cH:29][cH:30]1.[CH3:39][C:40]([CH3:41])([O-:42])[CH3:43].[K+:44].[OH:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6][c:7]([CH2:15][CH2:16][CH3:17])[nH:8][c:9]1[C:10](=[O:11])[O:12][CH2:13][CH3:14]>>[OH:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6][c:7]([CH2:15][CH2:16][CH3:17])[n:8]([CH2:37][c:34]2[cH:33][cH:32][c:31](-[c:26]3[c:25]([C:23]([NH:22][C:18]([CH3:19])([CH3:20])[CH3:21])=[O:24])[cH:30][cH:29][cH:28][cH:27]3)[cH:36][cH:35]2)[c:9]1[C:10](=[O:11])[O:12][CH2:13][CH3:14]