HRID1459890

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CNC(=O)C(Cc1ccc(OC)cc1)NC(=O)C1(CC(CCN2C(=O)c3cc4ccccc4cc3C2=O)C(=O)OC(C)(C)C)CCCC1

HCID86753503

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)C(Cc1ccc(OC)cc1)NC(=O)C1(CC(CCN2C(=O)c3cc4ccccc4cc3C2=O)C(=O)O)CCCC1

HCID74972390

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID6422

未命名化合物

PROCEDURE

实验过程

A solution of 4-(1,3-dioxo-1,3-dihydrobenzo[f]isoindol-2-yl)-2-{1-[2-(4-methoxyphenyl)-1-(methylcarbamoyl)ethylcarbamoyl]cyclopentylmethyl}butyric acid tert-butyl ester (diastereomer A) (45 mg, 0.069 mmol) in trifluoracetic acid (1 mL) was stirred overnight at room temperature. The solvent was evaporated under vacuum leaving a white foam which was triturated with ether to afford 4-(1,3-dioxo-1,3-dihydrobenzo[f]isoindol-2-yl)-2-{1-[2-(4-methoxyphenyl)-1-(methylcarbamoyl)ethylcarbamoyl]-cyclopentylmethyl}butyric acid (diastereomer A) as a white solid, 33 mg (80%). High Resolution Mass Spectrum M+ calculated for C34H37N3O7 : 599.2632; found:

WORKUP

后处理

customThe solvent was evaporated under vacuum
customleaving a white foam which
customwas triturated with ether

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-39d317cf0e104c1998daebd0780a1da3
来源数据集: uspto-grants-1998_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05854275
来源说明: uspto-grants-1998_12

反应 SMILES

C([O:5][C:6](=[O:48])[CH:7]([CH2:25][C:26]1([C:31](=[O:47])[NH:32][CH:33]([C:43](=[O:46])[NH:44][CH3:45])[CH2:34][C:35]2[CH:40]=[CH:39][C:38]([O:41][CH3:42])=[CH:37][CH:36]=2)[CH2:30][CH2:29][CH2:28][CH2:27]1)[CH2:8][CH2:9][N:10]1[C:18](=[O:19])[C:17]2[CH:16]=[C:15]3[CH:20]=[CH:21][CH:22]=[CH:23][C:14]3=[CH:13][C:12]=2[C:11]1=[O:24])(C)(C)C>FC(F)(F)C(O)=O>[O:19]=[C:18]1[C:17]2[CH:16]=[C:15]3[CH:20]=[CH:21][CH:22]=[CH:23][C:14]3=[CH:13][C:12]=2[C:11](=[O:24])[N:10]1[CH2:9][CH2:8][CH:7]([CH2:25][C:26]1([C:31](=[O:47])[NH:32][CH:33]([C:43](=[O:46])[NH:44][CH3:45])[CH2:34][C:35]2[CH:40]=[CH:39][C:38]([O:41][CH3:42])=[CH:37][CH:36]=2)[CH2:27][CH2:28][CH2:29][CH2:30]1)[C:6]([OH:48])=[O:5]