HRID687014

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID8071

未命名化合物

HCID19660

Carbonate Ion

CO3-2

HCID285645

4-Fluorophenylboronic acid

C6H6BFO2

HCID57560116

未命名化合物

PRODUCTS

产物

HCID57560104

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-0a043dee523942efb2daf2d662f75d6c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

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