HRID1179339

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)OC(=O)CC1CCN(CC(=O)O)C(=O)c2ccccc21

HCID69434194

未命名化合物

结构：N[C@H]1CC[C@H](CNc2nc3ccccc3[nH]2)CC1

HCID178511535

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)CC1CCN(CC(=O)NC2CCC(CNc3nc4ccccc4[nH]3)CC2)C(=O)c2ccccc21

HCID86591658

未命名化合物

PROCEDURE

实验过程

0.6 g (1.8 mmol) of compound 3 and 0.57 g (1.8 mmol) of compound 6 were reacted analogously to Example I and the reaction product was purified by means of preparative thick-layer chromatography (eluent: CH2Cl2/MeOH/ammonia, 45/5/0.2); 0.45 g of white amorphous powder; ESI-MS [M+H+]: 560.

WORKUP

后处理

customthe reaction product was purified by means of preparative thick-layer chromatography (eluent: CH2Cl2/MeOH/ammonia, 45/5/0.2)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-519d3c35d1d1464e843782d79c467a9b
来源数据集: uspto-grants-2007_10
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07279468B2
来源说明: uspto-grants-2007_10

反应 SMILES

[C:1]([O:5][C:6](=[O:24])[CH2:7][CH:8]1[C:14]2[CH:15]=[CH:16][CH:17]=[CH:18][C:13]=2[C:12](=[O:19])[N:11]([CH2:20][C:21](O)=[O:22])[CH2:10][CH2:9]1)([CH3:4])([CH3:3])[CH3:2].[NH2:25][C@H:26]1[CH2:31][CH2:30][C@H:29]([CH2:32][NH:33][C:34]2[NH:38][C:37]3[CH:39]=[CH:40][CH:41]=[CH:42][C:36]=3[N:35]=2)[CH2:28][CH2:27]1>>[NH:35]1[C:36]2[CH:42]=[CH:41][CH:40]=[CH:39][C:37]=2[N:38]=[C:34]1[NH:33][CH2:32][CH:29]1[CH2:30][CH2:31][CH:26]([NH:25][C:21](=[O:22])[CH2:20][N:11]2[CH2:10][CH2:9][CH:8]([CH2:7][C:6]([O:5][C:1]([CH3:3])([CH3:4])[CH3:2])=[O:24])[C:14]3[CH:15]=[CH:16][CH:17]=[CH:18][C:13]=3[C:12]2=[O:19])[CH2:27][CH2:28]1