HRID2317084

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID80170

2,5-Pyrrolidinedione, 1-hydroxy-

C4H5NO3

结构：CCCc1nc(C(O)C(C)(C)C)c(C(=O)O)n1Cc1ccc(-c2ccccc2C(=O)OC(C)(C)C)cc1

HCID19036116

未命名化合物

PRODUCTS

生成物

结构：CCCc1nc(C(O)C(C)(C)C)c(C(=O)ON2C(=O)CCC2=O)n1Cc1ccc(-c2ccccc2C(=O)OC(C)(C)C)cc1

HCID19036141

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-588aff29859f4b489c7e64e8ab2a2019
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])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[c:8]1[c:9](-[c:14]2[cH:15][cH:16][c:17]([CH2:20][n:21]3[c:22]([CH2:35][CH2:36][CH3:37])[n:23][c:24]([CH:29]([C:30]([CH3:31])([CH3:32])[CH3:33])[OH:34])[c:25]3[C:26](=[O:27])[OH:28])[cH:18][cH:19]2)[cH:10][cH:11][cH:12][cH:13]1.[OH:38][N:39]1[C:40](=[O:45])[CH2:41][CH2:42][C:43]1=[O:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[c:8]1[c:9](-[c:14]2[cH:15][cH:16][c:17]([CH2:20][n:21]3[c:22]([CH2:35][CH2:36][CH3:37])[n:23][c:24]([CH:29]([C:30]([CH3:31])([CH3:32])[CH3:33])[OH:34])[c:25]3[C:26](=[O:27])[O:28][N:39]3[C:40](=[O:45])[CH2:41][CH2:42][C:43]3=[O:44])[cH:18][cH:19]2)[cH:10][cH:11][cH:12][cH:13]1