HRID235528

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2761549

3-Amino-4-(1H-indol-3-yl)butanoic acid--hydrogen chloride (1/1)

C12H15ClN2O2

结构：COc1ccccc1CN(C)C(=O)[C@H](Cc1ccccc1)N(CC=O)C(=O)OC(C)(C)C

HCID86750254

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1CN(C)C(=O)[C@H](Cc1ccccc1)N(CCN[C@H](CC(=O)O)Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C

HCID86750253

未命名化合物

PROCEDURE

实验过程

Prepare by the method of Example 1 using (S)-N-(2-methoxybenzyl)-N-methyl-2-[N'-(t-butoxycarbonyl)-2-oxo-ethylamino]-3-phenyl-propionamide (0.71 g, 1.6 mmol) and (S)-2-(1H-indol-3-yl)-1-carboxymethyl-ethylamine hydrochloride salt ((S)-tryptophan methyl ester hydrochloride salt) (0.45 g, 1.76 mmol). Purify by chromatography eluting with 50% ethyl acetate/hexane to give the title compound: TLC Rf =0.56 (silica gel, 50% ethyl acetate/hexane)

WORKUP

后处理

customPurify by chromatography
washeluting with 50% ethyl acetate/hexane

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fbd2011306d34402ae411206f0e5ca49
来源数据集: uspto-grants-1997_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05597845
来源说明: uspto-grants-1997_01

反应 SMILES

[CH3:1][O:2][C:3]1[CH:32]=[CH:31][CH:30]=[CH:29][C:4]=1[CH2:5][N:6]([CH3:28])[C:7](=[O:27])[C@@H:8]([N:16]([CH2:24][CH:25]=O)[C:17]([O:19][C:20]([CH3:23])([CH3:22])[CH3:21])=[O:18])[CH2:9][C:10]1[CH:15]=[CH:14][CH:13]=[CH:12][CH:11]=1.Cl.[NH:34]1[C:42]2[C:37](=[CH:38][CH:39]=[CH:40][CH:41]=2)[C:36]([CH2:43][C@H:44]([NH2:49])[CH2:45][C:46]([OH:48])=[O:47])=[CH:35]1>>[CH3:1][O:2][C:3]1[CH:32]=[CH:31][CH:30]=[CH:29][C:4]=1[CH2:5][N:6]([CH3:28])[C:7](=[O:27])[C@@H:8]([N:16]([CH2:24][CH2:25][NH:49][C@H:44]([CH2:45][C:46]([OH:48])=[O:47])[CH2:43][C:36]1[C:37]2[C:42](=[CH:41][CH:40]=[CH:39][CH:38]=2)[NH:34][CH:35]=1)[C:17]([O:19][C:20]([CH3:22])([CH3:23])[CH3:21])=[O:18])[CH2:9][C:10]1[CH:15]=[CH:14][CH:13]=[CH:12][CH:11]=1