HRID735537

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID15620607

Oxoacetic acid--water (1/1)

C2H4O4

结构：CC(C)S(=O)(=O)c1ccc(NC(=O)CCCc2ccc(B(O)O)cc2)cc1CN(C)C(=O)OC(C)(C)C

HCID57842719

未命名化合物

结构：CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1nccc2cc(N)ccc12

HCID58717298

未命名化合物

PRODUCTS

生成物

结构：CC(C)S(=O)(=O)c1ccc(NC(=O)CCCc2ccc(C(Nc3ccc4c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)nccc4c3)C(=O)O)cc2)cc1CN(C)C(=O)OC(C)(C)C

HCID57842755

未命名化合物

PROCEDURE

实验过程

Using a procedure analogous to that used to prepare 2D, 18C (0.151 g, 0.28 mmol) was reacted with Intermediate 1 (0.101 g, 0.28 mmol) and glyoxylic acid monohydrate (0.026 g, 0.28 mmol) to give, after purification by reverse phase HPLC, 18D (168 mg, 66%) as a yellow glass.

WORKUP

后处理

customto give
customafter purification by reverse phase HPLC, 18D (168 mg, 66%) as a yellow glass

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f66eb81b81944c32adb50bedf8a85693
来源数据集: uspto-grants-2009_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07592331B2
来源说明: uspto-grants-2009_09

反应 SMILES

[C:1]([O:5][C:6]([N:8]([CH2:10][C:11]1[CH:12]=[C:13]([NH:23][C:24](=[O:37])[CH2:25][CH2:26][CH2:27][C:28]2[CH:33]=[CH:32][C:31](B(O)O)=[CH:30][CH:29]=2)[CH:14]=[CH:15][C:16]=1[S:17]([CH:20]([CH3:22])[CH3:21])(=[O:19])=[O:18])[CH3:9])=[O:7])([CH3:4])([CH3:3])[CH3:2].[NH2:38][C:39]1[CH:40]=[C:41]2[C:46](=[CH:47][CH:48]=1)[C:45]([N:49]([C:57]([O:59][C:60]([CH3:63])([CH3:62])[CH3:61])=[O:58])[C:50]([O:52][C:53]([CH3:56])([CH3:55])[CH3:54])=[O:51])=[N:44][CH:43]=[CH:42]2.O.[C:65]([OH:69])(=[O:68])[CH:66]=O>>[C:60]([O:59][C:57]([N:49]([C:50]([O:52][C:53]([CH3:54])([CH3:55])[CH3:56])=[O:51])[C:45]1[C:46]2[C:41](=[CH:40][C:39]([NH:38][CH:66]([C:31]3[CH:32]=[CH:33][C:28]([CH2:27][CH2:26][CH2:25][C:24]([NH:23][C:13]4[CH:14]=[CH:15][C:16]([S:17]([CH:20]([CH3:22])[CH3:21])(=[O:19])=[O:18])=[C:11]([CH2:10][N:8]([C:6]([O:5][C:1]([CH3:4])([CH3:3])[CH3:2])=[O:7])[CH3:9])[CH:12]=4)=[O:37])=[CH:29][CH:30]=3)[C:65]([OH:69])=[O:68])=[CH:48][CH:47]=2)[CH:42]=[CH:43][N:44]=1)=[O:58])([CH3:63])([CH3:62])[CH3:61]