HRID281566

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID13445020

未命名化合物

HCID23030321

tert-Butyl [5-(bromomethyl)pyridin-2-yl]carbamate

C11H15BrN2O2

PRODUCTS

生成物

结构：CCCCC(C(=O)OCC)C(Cc1ccc(NC(=O)OC(C)(C)C)nc1)(C(=O)OCC)C(=O)OCC

HCID54243525

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-19ac92c58e854873ad034a9211773d21
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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