HRID655826

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8406

Benzoic acid, 2-formyl-

C8H6O3

结构：CC(C)(C)OC(=O)C[C@H](N)C(O)COc1c(F)c(F)cc(F)c1F

HCID44604220

1,1-Dimethylethyl (4ξ)-3-amino-2,3-dideoxy-5-O-(2,3,5,6-tetrafluorophenyl)-D-glycero-pentonate

C15H19F4NO4

HCID66593632

未命名化合物

PRODUCTS

生成物

结构：CC[C@@H](C(=O)N[C@@H](CC(=O)OC(C)(C)C)C(=O)COc1c(F)c(F)cc(F)c1F)n1ccc2ccccc2c1=O

HCID86594402

未命名化合物

PROCEDURE

实验过程

This compound was prepared using (S)-2-(1-oxo-1H-isoquinolin-2-yl)-butyric acid (prepared from 2-formylbenzoic acid using procedures similar to those described in methods A-E) and (3S)-3-Amino-4-hydroxy-5-(2,3,5,6-tetrafluoro-phenoxy)-pentanoic acid tert-butyl ester (prepared as described in methods H-J) using procedures similar to those described in methods F-G. This compound was isolated as a white solid

WORKUP

后处理

customThis compound was prepared
customThis compound was isolated as a white solid

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a101814c9c6e4eefb35182d505192723
来源数据集: uspto-grants-2011_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08071618B2
来源说明: uspto-grants-2011_12

反应 SMILES

[O:1]=[C:2]1[C:11]2[C:6](=[CH:7][CH:8]=[CH:9][CH:10]=2)[CH:5]=[CH:4][N:3]1[C@@H:12]([CH2:16][CH3:17])[C:13]([OH:15])=O.C(C1C=CC=CC=1C(O)=O)=O.[C:29]([O:33][C:34](=[O:52])[CH2:35][C@H:36]([NH2:51])[CH:37]([OH:50])[CH2:38][O:39][C:40]1[C:45]([F:46])=[C:44]([F:47])[CH:43]=[C:42]([F:48])[C:41]=1[F:49])([CH3:32])([CH3:31])[CH3:30]>>[C:29]([O:33][C:34](=[O:52])[CH2:35][C@H:36]([NH:51][C:13](=[O:15])[C@@H:12]([N:3]1[CH:4]=[CH:5][C:6]2[C:11](=[CH:10][CH:9]=[CH:8][CH:7]=2)[C:2]1=[O:1])[CH2:16][CH3:17])[C:37](=[O:50])[CH2:38][O:39][C:40]1[C:45]([F:46])=[C:44]([F:47])[CH:43]=[C:42]([F:48])[C:41]=1[F:49])([CH3:32])([CH3:30])[CH3:31]