HRID319924

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID1117

Sulfate

O4S-2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID86804

Heptane, 3-(bromomethyl)-

C8H17Br

HCID20441676

未命名化合物

PRODUCTS

生成物

HCID57857730

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8129061fafd44bb5937dfb7ad592ac9e
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

[Br:23][CH2:24][CH:25]([CH2:26][CH3:27])[CH2:28][CH2:29][CH2:30][CH3:31].[C:17](=[O:18])([O-:19])[O-:20].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[K+:21].[K+:22].[Na+:32].[Na+:33].[O-:34][S:35](=[O:36])(=[O:37])[O-:38].[OH2:45].[c:1]1([NH:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][C:13](=[O:14])[O:15][CH3:16])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([N:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][C:13](=[O:14])[O:15][CH3:16])[CH2:24][CH:25]([CH2:26][CH3:27])[CH2:28][CH2:29][CH2:30][CH3:31])[cH:2][cH:3][cH:4][cH:5][cH:6]1