HRID2320479

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID7909

4-Methyl-2-pentanone

C6H12O

HCID19660

Carbonate

CO3-2

HCID96387

4-Phenylpiperidin-4-ol

C11H15NO

HCID54469994

未命名化合物

PRODUCTS

生成物

HCID21331966

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-091d105e06d647578b29b96991072790
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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