HRID1432344

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID81531

Diisopropylethylamine

C8H19N

HCID859640

未命名化合物

结构：CN(C)C(On1nnc2ccccc21)=[N+](C)C.F[P-](F)(F)(F)(F)F

HCID2733084

Methanaminium, N-[(1H-benzotriazol-1-yloxy)(dimethylamino)methylene]-N-methyl-, hexafluorophosphate(1-) (1:1)

C11H16F6N5OP

结构：CCc1ccc(CN(CC[C@@H](O)[C@@H](N)Cc2ccccc2)Cc2ccc(CC)cc2)cc1

HCID68890594

未命名化合物

PRODUCTS

生成物

结构：CCc1ccc(CN(CC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)C2=Cc3ccccc3Oc3ccccc32)Cc2ccc(CC)cc2)cc1

HCID86612521

未命名化合物

收率 34.4%

PROCEDURE

实验过程

A solution of (2S,3R)-2-Amino-5-[bis-(4-ethyl-benzyl)-amino]-1-phenyl-pentan-3-ol (13 mg), salt with two trifluoroacetic acids, Dibenzo[b,f]oxepine-10-carboxylic acid (5 mg), HBTU (11 mg) and N-Ethyl-diisopropylamine (0.007 ml in 2 ml DCM) is stirred for 16 h at rt. The reaction mixture is evaporated and purified by flash chromatography with hexane/EtOAc/NH3=3/1/0.01. 4.7 mg of desired product are obtained.

WORKUP

后处理

customThe reaction mixture is evaporated
custompurified by flash chromatography with hexane/EtOAc/NH3=3/1/0.01

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e9b55a01618a4d2a820f2126d36b7b94
来源数据集: uspto-grants-2009_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07612054B2
来源说明: uspto-grants-2009_11

反应 SMILES

[NH2:1][C@H:2]([C@H:10]([OH:32])[CH2:11][CH2:12][N:13]([CH2:23][C:24]1[CH:29]=[CH:28][C:27]([CH2:30][CH3:31])=[CH:26][CH:25]=1)[CH2:14][C:15]1[CH:20]=[CH:19][C:18]([CH2:21][CH3:22])=[CH:17][CH:16]=1)[CH2:3][C:4]1[CH:9]=[CH:8][CH:7]=[CH:6][CH:5]=1.[CH:33]1[C:43]2[CH:42]=[C:41]([C:44](O)=[O:45])[C:40]3[CH:47]=[CH:48][CH:49]=[CH:50][C:39]=3[O:38][C:37]=2[CH:36]=[CH:35][CH:34]=1.CN(C(ON1N=NC2C=CC=CC1=2)=[N+](C)C)C.F[P-](F)(F)(F)(F)F.C(N(C(C)C)C(C)C)C>>[CH2:3]([C@H:2]([NH:1][C:44]([C:41]1[C:40]2[CH:47]=[CH:48][CH:49]=[CH:50][C:39]=2[O:38][C:37]2[CH:36]=[CH:35][CH:34]=[CH:33][C:43]=2[CH:42]=1)=[O:45])[C@H:10]([OH:32])[CH2:11][CH2:12][N:13]([CH2:23][C:24]1[CH:25]=[CH:26][C:27]([CH2:30][CH3:31])=[CH:28][CH:29]=1)[CH2:14][C:15]1[CH:16]=[CH:17][C:18]([CH2:21][CH3:22])=[CH:19][CH:20]=1)[C:4]1[CH:5]=[CH:6][CH:7]=[CH:8][CH:9]=1