HRID2348433

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID31374

Dimethylacetamide

C4H9NO

HCID62365

Isobutyl chloroformate

C5H9ClO2

HCID322640

DL-Acetylproline

C7H11NO3

HCID12918956

未命名化合物

PRODUCTS

生成物

结构：CC(=O)N1CCCC1C(=O)Nc1ccc(-c2ccc(C(=O)O)c(=O)[nH]2)cc1

HCID12918963

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-14e81c65cb274dfe832449a61a560a8a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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