HRID945863

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID99174

3-Phenylfuran-2,5-dione

C10H6O3

结构：CNC(=O)C(CC(C)C)NC(=O)C(CC(C)C)CP(=O)(CN)OC

HCID178485695

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)C(CC(C)C)NC(=O)C(CC(C)C)CP(=O)(CN1C(=O)C=C(c2ccccc2)C1=O)OC

HCID178485691

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e237133f6837440b9f7fadbad16fbb1e
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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