HRID672564

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6212

Chloroform

CHCl3

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID75737

(+/-)-Phenylalanine methyl ester

C10H13NO2

HCID80170

2,5-Pyrrolidinedione, 1-hydroxy-

C4H5NO3

HCID271761

3-Formyl-4-hydroxybenzoic acid

C8H6O4

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccccc1)NC(=O)c1ccc(O)c(C=O)c1

HCID19104795

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-83b84bf078404b8cab0c73a2f2430350
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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