HRID115215

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID86977

未命名化合物

HCID718815

未命名化合物

PRODUCTS

产物

HCID46871525

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-510febb2e5f6497c935ea7808b7bf62d
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

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