HRID162729

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID923

Sodium ion

Na+

HCID2724942

未命名化合物

HCID10609430

4-(tert-Butyldimethylsilyloxy)cyclohexanone

C12H24O2Si

HCID23361771

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)[Si](C)(C)OC1CCC(Nc2cnnn2Cc2ccccc2)CC1

HCID67009120

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8d97ca3f30564bc38eca7677e429a298
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:14]([CH3:15])([CH3:16])([CH3:17])[Si:18]([O:19][CH:20]1[CH2:21][CH2:22][C:23](=[O:26])[CH2:24][CH2:25]1)([CH3:27])[CH3:28].[C:29]([O:30][BH-:31]([O:32][C:33](=[O:34])[CH3:35])[O:36][C:37](=[O:38])[CH3:39])(=[O:40])[CH3:41].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[n:9][n:10][cH:11][c:12]1[NH2:13].[CH3:43][C:44](=[O:45])[OH:46].[Na+:42]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[n:9][n:10][cH:11][c:12]1[NH:13][CH:23]1[CH2:22][CH2:21][CH:20]([O:19][Si:18]([C:14]([CH3:15])([CH3:16])[CH3:17])([CH3:27])[CH3:28])[CH2:25][CH2:24]1