HRID1556351

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

2 次

HCID7972

4-Methylmorpholine

C5H11NO

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID99767

未命名化合物

HCID3769726

2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoic Acid

C15H21NO4

PRODUCTS

生成物

结构：CCOC(=O)C(CCc1ccccc1)NC(C)C(=O)N1CCCC1C(=O)OCc1ccccc1

HCID13105156

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f85d035a3fcd426da0aa8dd8e75e2061
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH2:18]([CH3:19])[O:20][C:21](=[O:22])[CH:23]([CH2:24][CH2:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[NH:32][CH:33]([CH3:34])[C:35](=[O:36])[OH:37].[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[O:9][C:10]([CH:11]1[NH:12][CH2:13][CH2:14][CH2:15]1)=[O:16].[CH2:78]([Cl:79])[Cl:80].[CH3:38][N:39]1[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1.[CH:55]1([N:56]=[C:57]=[N:58][CH:59]2[CH2:60][CH2:61][CH2:62][CH2:63][CH2:64]2)[CH2:65][CH2:66][CH2:67][CH2:68][CH2:69]1.[Cl:75][CH2:76][Cl:77].[ClH:17].[ClH:1].[O:70]=[CH:71][N:72]([CH3:73])[CH3:74].[OH:45][n:46]1[c:47]2[cH:48][cH:49][cH:50][cH:51][c:52]2[n:53][n:54]1>>[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[O:9][C:10]([CH:11]1[N:12]([C:35]([CH:33]([NH:32][CH:23]([C:21]([O:20][CH2:18][CH3:19])=[O:22])[CH2:24][CH2:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH3:34])=[O:36])[CH2:13][CH2:14][CH2:15]1)=[O:16]