HRID1058338

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID181649

3H-1,2,3-Triazolo[4,5-b]pyridine, 3-hydroxy-

C5H4N4O

结构：CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O

HCID1797945

N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanyl-L-proline

C19H26N2O5

HCID11149921

TERT-BUTYL 2-(AMINOMETHYL)-4-CHLOROBENZYLCARBAMATE

C13H19ClN2O2

PRODUCTS

生成物

结构：CC(C)(C)OCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCc1cc(Cl)ccc1CNC(=O)OC(C)(C)C

HCID69939891

未命名化合物

PROCEDURE

实验过程

To a solution of tert-Butyl 2-(aminomethyl)-4-chlorobenzylcarbamate (0.14 mmol, 37 mg), EDC (0.21 mmol, 40 mg), and Boc-D-Phe-Pro-OH (0.14 mmol, 50 mg), in 0.5 mL dimethylformamide, was added HOAT (0.15 mmol, 21 mg). The solution was stirred overnight and purified by prep HPLC to give N-(tert-Butoxyacetyl)-D-phenylalanyl-N-(2-{[(tert-butoxycarbonyl)amino]methyl}-5-chlorobenzyl)-L-prolinamide. Mass Spec ES (M+1)=615.2.

WORKUP

后处理

custompurified by prep HPLC

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2ed7789c584847d9a31369e434f6a513
来源数据集: uspto-grants-2003_02
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06515011B2
来源说明: uspto-grants-2003_02

反应 SMILES

[NH2:1][CH2:2][C:3]1[CH:17]=[C:16]([Cl:18])[CH:15]=[CH:14][C:4]=1[CH2:5][NH:6][C:7](=[O:13])[O:8][C:9]([CH3:12])([CH3:11])[CH3:10].[CH2:19](Cl)CCl.[NH:23]([C:42]([O:44]C(C)(C)C)=O)[C@@H:24]([C:32]([N:34]1[CH2:41][CH2:40][CH2:39][C@H:35]1[C:36]([OH:38])=O)=[O:33])[CH2:25][C:26]1[CH:31]=[CH:30][CH:29]=[CH:28][CH:27]=1.C1C=N[C:52]2N(O)N=N[C:51]=2[CH:50]=1.CN(C)[CH:61]=[O:62]>>[C:51]([O:62][CH2:61][C:42]([NH:23][C@@H:24]([C:32]([N:34]1[CH2:41][CH2:40][CH2:39][C@H:35]1[C:36]([NH:1][CH2:2][C:3]1[CH:17]=[C:16]([Cl:18])[CH:15]=[CH:14][C:4]=1[CH2:5][NH:6][C:7]([O:8][C:9]([CH3:12])([CH3:11])[CH3:10])=[O:13])=[O:38])=[O:33])[CH2:25][C:26]1[CH:27]=[CH:28][CH:29]=[CH:30][CH:31]=1)=[O:44])([CH3:50])([CH3:52])[CH3:19]