HRID309336

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID13041

Pentafluorophenol

C6HF5O

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75737

(+/-)-Phenylalanine methyl ester

C10H13NO2

HCID10515816

2-(Benzyl(tert-butoxycarbonyl)amino)acetic acid

C14H19NO4

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccccc1)NC(=O)CN(Cc1ccccc1)C(=O)OC(C)(C)C

HCID66941114

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ccddde7da72942f182f16cd2387dcee4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:25](=[O:26])([O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[N:32]([CH2:33][C:34](=[O:35])[OH:36])[CH2:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[CH3:2][N:3]([CH3:4])[CH2:5][CH2:6][CH2:7][N:8]=[C:9]=[N:10][CH2:11][CH3:12].[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[CH3:52][O:53][C:54]([CH:55]([NH2:56])[CH2:57][c:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1)=[O:64].[CH3:68][CH2:69][O:70][C:71]([CH3:72])=[O:73].[Cl:65][CH2:66][Cl:67].[ClH:1].[ClH:51].[F:13][c:14]1[c:15]([OH:16])[c:17]([F:18])[c:19]([F:20])[c:21]([F:22])[c:23]1[F:24]>>[C:25](=[O:26])([O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[N:32]([CH2:33][C:34](=[O:36])[NH:56][CH:55]([C:54]([O:53][CH3:52])=[O:64])[CH2:57][c:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1)[CH2:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1