HRID2037380

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID2734767

Methyl 3-aminopropionate hydrochloride

C4H10ClNO2

结构：CCc1cc(-c2noc(-c3cc(C)c(CC(C)C)cn3)n2)cc(C)c1OC[C@@H](O)CNC

HCID68629918

未命名化合物

PRODUCTS

生成物

结构：CCc1cc(-c2noc(-c3cc(C)c(CC(C)C)cn3)n2)cc(C)c1OC[C@@H](O)CNCCC(=O)OC

HCID68631224

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID887

Methanol

CH4O

PROCEDURE

实验过程

A solution of the epoxide intermediate of Example 57 (step a, 150 mg, 368 μmol), β-alanine methyl ester hydrochloride (113 mg, 736 μmol) and triethylamine (93 mg, 920 μmol) in methanol (5 mL) is stirred at 60° C. for 20 h. The solvent is removed in vacuo and the crude product is purified on prep. TLC plates using DCM:methanol 10:1 to give the title compound (53 mg) as a colourless oil; LC-MS: tR=0.92 min, [M+H]+=511.18.

WORKUP

后处理

customThe solvent is removed in vacuo
customthe crude product is purified on prep

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ada813ea36264dcd92d44d771c3a3299
来源数据集: uspto-grants-2013_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08575200B2
来源说明: uspto-grants-2013_11

反应 SMILES

[CH2:1]([C:3]1[CH:15]=[C:14]([C:16]2[N:20]=[C:19]([C:21]3[CH:26]=[C:25]([CH3:27])[C:24]([CH2:28][CH:29]([CH3:31])[CH3:30])=[CH:23][N:22]=3)[O:18][N:17]=2)[CH:13]=[C:12]([CH3:32])[C:4]=1[O:5][CH2:6][C@@H:7]([OH:11])[CH2:8][NH:9][CH3:10])[CH3:2].Cl.[CH3:34][O:35][C:36](=[O:40])[CH2:37]CN.C(N(CC)CC)C>CO>[CH3:34][O:35][C:36](=[O:40])[CH2:37][CH2:10][NH:9][CH2:8][C@H:7]([OH:11])[CH2:6][O:5][C:4]1[C:12]([CH3:32])=[CH:13][C:14]([C:16]2[N:20]=[C:19]([C:21]3[CH:26]=[C:25]([CH3:27])[C:24]([CH2:28][CH:29]([CH3:31])[CH3:30])=[CH:23][N:22]=3)[O:18][N:17]=2)=[CH:15][C:3]=1[CH2:1][CH3:2]