HRID313074

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID8471

Triethylamine

C6H15N

HCID10726

(+/-)-2-Phenyl-3-hydroxypropionic acid

C9H10O3

HCID10928

Ethyl chloroformate

C3H5ClO2

结构：COc1cc(N)c(Cl)cc1C(=O)NC1CCN(CCN)CC1OC

HCID14854953

未命名化合物

PRODUCTS

生成物

结构：COc1cc(N)c(Cl)cc1C(=O)NC1CCN(CCNC(=O)C(CO)c2ccccc2)CC1OC

HCID19994866

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-886cd96874fe46fc969ded5a08279fd0
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:13]([Cl:14])(=[O:15])[O:16][CH2:17][CH3:18].[CH3:47][CH2:48][N:49]([CH2:50][CH3:51])[CH2:52][CH3:53].[Cl:43][CH:44]([Cl:45])[Cl:46].[NH2:19][c:20]1[cH:21][c:22]([O:41][CH3:42])[c:23]([C:24](=[O:25])[NH:26][CH:27]2[CH:28]([O:36][CH3:37])[CH2:29][N:30]([CH2:33][CH2:34][NH2:35])[CH2:31][CH2:32]2)[cH:38][c:39]1[Cl:40].[OH:1][CH2:2][CH:3]([C:4](=[O:5])[OH:6])[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1>>[OH:1][CH2:2][CH:3]([C:4](=[O:6])[NH:35][CH2:34][CH2:33][N:30]1[CH2:29][CH:28]([O:36][CH3:37])[CH:27]([NH:26][C:24]([c:23]2[c:22]([O:41][CH3:42])[cH:21][c:20]([NH2:19])[c:39]([Cl:40])[cH:38]2)=[O:25])[CH2:32][CH2:31]1)[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1