HRID141331

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID7909

4-Methyl-2-pentanone

C6H12O

HCID19660

Carbonate

CO3-2

HCID30165

Iodide ion

I-

HCID702235

未命名化合物

HCID9837283

未命名化合物

PRODUCTS

产物

HCID11440344

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-268379bb7cc746f0bc55a9e9427f5255
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

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