HRID1564725

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID962

Water

H2O

HCID1061

Phosphate

O4P-3

HCID8071

未命名化合物

HCID2734369

[4-(Methoxycarbonyl)phenyl]boronic acid

C8H9BO4

HCID57930980

1,1-Dimethylethyl 4-bromo-3,5-diethoxybenzoate

C15H21BrO4

PRODUCTS

生成物

结构：CCOc1cc(C(=O)OC(C)(C)C)cc(OCC)c1-c1ccc(C(=O)OC)cc1

HCID67055556

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e27bb10f4ad1489186946abd335d6760
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Br:15][c:16]1[c:17]([O:32][CH2:33][CH3:34])[cH:18][c:19]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[cH:27][c:28]1[O:29][CH2:30][CH3:31].[CH3:2][O:3][C:4](=[O:5])[c:6]1[cH:7][cH:8][c:9]([B:12]([OH:13])[OH:14])[cH:10][cH:11]1.[CH3:43][O:44][CH2:45][CH2:46][O:47][CH3:48].[K+:40].[K+:41].[K+:42].[OH2:1].[P:35]([O-:36])([O-:37])([O-:38])=[O:39]>>[CH3:2][O:3][C:4](=[O:5])[c:6]1[cH:7][cH:8][c:9](-[c:16]2[c:17]([O:32][CH2:33][CH3:34])[cH:18][c:19]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[cH:27][c:28]2[O:29][CH2:30][CH3:31])[cH:10][cH:11]1