HRID107264

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID679

Dimethyl sulfoxide

C2H6OS

HCID753

Glycerol

C3H8O3

HCID813

Potassium cation

K+

3 次

HCID923

Sodium ion

Na+

HCID1061

Phosphate

O4P-3

HCID8857

Ethyl acetate

C4H8O2

HCID24749

Hexose

C6H12O6

HCID22022910

未命名化合物

PRODUCTS

生成物

HCID9992659

2-isobutyl-3-ketoglutarate diethyl ester

C13H22O5

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c729b51728bd410d90fc552edaf16c0b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:23]([CH3:24])[O:25][C:26]([CH:27]([C:28]([C:29]([C:30](=[O:31])[O:32][CH2:33][CH3:34])=[O:35])=[O:36])[CH2:37][CH:38]([CH3:39])[CH3:40])=[O:41].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[CH3:54][S:55]([CH3:56])=[O:57].[Cl-:9].[K+:6].[K+:7].[K+:8].[Na+:10].[O:11]=[CH:12][CH:13]([CH:14]([CH:15]([CH:16]([CH2:17][OH:18])[OH:19])[OH:20])[OH:21])[OH:22].[OH:48][CH2:49][CH:50]([CH2:51][OH:52])[OH:53].[P:1]([O-:2])([O-:3])([O-:4])=[O:5]>>[CH2:23]([CH3:24])[O:25][C:26]([CH:27]([C:28]([CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])=[O:36])[CH2:37][CH:38]([CH3:39])[CH3:40])=[O:41]