HRID1210929

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID21642

1-Bromopinacolone

C6H11BrO

HCID166653

Hydride

H-

结构：COC(=O)C(CCC(=O)OC(C)(C)C)NC(=O)c1cc(O)n(-c2ccccc2)n1

HCID178500445

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(CCC(=O)OC(C)(C)C)NC(=O)c1cc(OCC(=O)C(C)(C)C)n(-c2ccccc2)n1

HCID178500441

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-591ba9e3522c4bd2828ae49a2b9e0476
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[Br:32][CH2:33][C:34]([C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39].[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH2:6][C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[NH:14][C:15](=[O:16])[c:17]1[n:18][n:19](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:20]([OH:22])[cH:21]1)=[O:29].[H-:30].[Na+:31].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH2:6][C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[NH:14][C:15](=[O:16])[c:17]1[n:18][n:19](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:20]([O:22][CH2:33][C:34]([C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39])[cH:21]1)=[O:29]