HRID1958005

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)OC(=O)N[C@@H](C(=O)O)C1CCCCC1

HCID7014890

(2R)-[(tert-Butoxycarbonyl)amino](cyclohexyl)acetic acid

C13H23NO4

结构：CC(C)N1CC(=O)N(C)c2cnc(Nc3cc(N)cc(S(C)(=O)=O)c3)nc21

HCID59286174

未命名化合物

PRODUCTS

生成物

结构：CC(C)N1CC(=O)N(C)c2cnc(Nc3cc(NC(=O)[C@H](NC(=O)OC(C)(C)C)C4CCCCC4)cc(S(C)(=O)=O)c3)nc21

HCID68425193

未命名化合物

收率 17.5%

PROCEDURE

实验过程

Starting from (R)-tert-butoxycarbonylamino-cyclohexyl-acetic acid (31.6 mg; 0.123 mmol) and 2-(3-amino-5-(methylsulfonyl)-phenylamino)-8-isopropyl-5-methyl-7,8-dihydro-5H-pteridin-6-one (40 mg; 0.102), 11.3 mg (0.018 mmol; 17.5% yield) of the desired compound were obtained.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a6584675449e4f07a9f4632bb2791d35
来源数据集: uspto-grants-2013_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08410100B2
来源说明: uspto-grants-2013_04

反应 SMILES

[C:1]([O:5][C:6]([NH:8][C@H:9]([CH:13]1[CH2:18][CH2:17][CH2:16][CH2:15][CH2:14]1)[C:10]([OH:12])=O)=[O:7])([CH3:4])([CH3:3])[CH3:2].[NH2:19][C:20]1[CH:21]=[C:22]([NH:30][C:31]2[N:40]=[CH:39][C:38]3[N:37]([CH3:41])[C:36](=[O:42])[CH2:35][N:34]([CH:43]([CH3:45])[CH3:44])[C:33]=3[N:32]=2)[CH:23]=[C:24]([S:26]([CH3:29])(=[O:28])=[O:27])[CH:25]=1>>[C:1]([O:5][C:6](=[O:7])[NH:8][C@H:9]([CH:13]1[CH2:18][CH2:17][CH2:16][CH2:15][CH2:14]1)[C:10](=[O:12])[NH:19][C:20]1[CH:25]=[C:24]([S:26]([CH3:29])(=[O:27])=[O:28])[CH:23]=[C:22]([NH:30][C:31]2[N:40]=[CH:39][C:38]3[N:37]([CH3:41])[C:36](=[O:42])[CH2:35][N:34]([CH:43]([CH3:45])[CH3:44])[C:33]=3[N:32]=2)[CH:21]=1)([CH3:2])([CH3:3])[CH3:4]