HRID458739

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID444972

Fumaric acid

C4H4O4

HCID6364607

Disodium fumarate

C4H2Na2O4

结构：Cl.N=CN1CCC(CCOC(=O)[C@](O)(c2ccccc2)[C@@H]2CCC(F)(F)C2)CC1

HCID86589930

未命名化合物

PRODUCTS

生成物

结构：N=CN1CCC(CCOC(=O)[C@](O)(c2ccccc2)[C@@H]2CCC(F)(F)C2)CC1.O=C(O)/C=C/C(=O)O

HCID20753103

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID962

Water

H2O

2 次

PROCEDURE

实验过程

A solution of 75 mg g of 2-(1-(iminomethyl)piperidin-4-yl)-ethyl (2R)-2-((1R)-3,3-difluorocyclopentyl)-2-hydroxy-2-phenylethanoate monohydrochloride in 2 ml of ultrapure water was developed on reversed phase medium pressure liquid chromatography [ODS-AQ 120-S50 (YMC Co.)], and 60 ml of 0.2 M aqueous sodium monofumarate solution, 60 ml of aqueous fumaric acid solution and 100 ml of ultrapure water were flowed by the order stated. The title compound was eluted from tetrahydrofuran/water=1/4. Condensing the same to dry solid, 41 mg of a colorless solid was obtained.

WORKUP

后处理

washThe title compound was eluted from tetrahydrofuran/water=1/4
customCondensing the same
customto dry solid

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fd32d6b6aa6f445683f55f8e88a7a3be
来源数据集: uspto-grants-2007_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07192969B2
来源说明: uspto-grants-2007_03

反应 SMILES

Cl.[F:2][C:3]1([F:29])[CH2:7][CH2:6][C@@H:5]([C@@:8]([OH:28])([C:22]2[CH:27]=[CH:26][CH:25]=[CH:24][CH:23]=2)[C:9]([O:11][CH2:12][CH2:13][CH:14]2[CH2:19][CH2:18][N:17]([CH:20]=[NH:21])[CH2:16][CH2:15]2)=[O:10])[CH2:4]1.[C:30]([O-:37])(=[O:36])/[CH:31]=[CH:32]/[C:33]([O-:35])=[O:34].[Na+].[Na+].C(O)(=O)/C=C/C(O)=O>O>[C:30]([OH:37])(=[O:36])/[CH:31]=[CH:32]/[C:33]([OH:35])=[O:34].[F:29][C:3]1([F:2])[CH2:7][CH2:6][C@@H:5]([C@@:8]([OH:28])([C:22]2[CH:23]=[CH:24][CH:25]=[CH:26][CH:27]=2)[C:9]([O:11][CH2:12][CH2:13][CH:14]2[CH2:15][CH2:16][N:17]([CH:20]=[NH:21])[CH2:18][CH2:19]2)=[O:10])[CH2:4]1