HRID961370

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID102688

Phenylalanine ethyl ester

C11H15NO2

结构：CC(NP(=O)(Cc1ccccc1)Cc1ccccc1)C(=O)N1CCCC1C(=O)O

HCID23320611

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(Cc1ccccc1)NC(=O)C1CCCN1C(=O)C(C)NP(=O)(Cc1ccccc1)Cc1ccccc1

HCID178470886

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a660af241d2e4806a2ee003cc7add72f
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[P:8](=[O:9])([CH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[NH:17][CH:18]([CH3:19])[C:20](=[O:21])[N:22]1[CH:23]([C:24](=[O:25])[OH:26])[CH2:27][CH2:28][CH2:29]1.[CH2:41]([CH3:42])[O:43][C:44]([CH:45]([NH2:46])[CH2:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)=[O:54].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[ClH:40].[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[OH:30][n:31]1[c:32]2[c:33]([cH:34][cH:35][cH:36][cH:37]2)[n:38][n:39]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[P:8](=[O:9])([CH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[NH:17][CH:18]([CH3:19])[C:20](=[O:21])[N:22]1[CH:23]([C:24](=[O:25])[NH:46][CH:45]([C:44]([O:43][CH2:41][CH3:42])=[O:54])[CH2:47][c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[CH2:27][CH2:28][CH2:29]1