HRID1120654

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

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

HCID61778

Bisulfate anion

HO4S-

HCID22708452

未命名化合物

PRODUCTS

产物

HCID22708427

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-cb929d53ba2d46e581808703048a3930
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][c:10]([CH2:31][CH:32]([C:33](=[O:34])[O:35][CH2:36][CH3:37])[O:38][CH2:39][CH3:40])[cH:11][cH:12][c:13]1[O:14][CH2:15][CH2:16][c:17]1[cH:18][cH:19][c:20]([NH:23][C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[cH:21][cH:22]1.[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[CH3:55][CH2:56][OH:57].[K+:53].[Li+:41].[OH-:42].[OH2:54].[S:48]([O-:49])([OH:50])(=[O:51])=[O:52]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][c:10]([CH2:31][CH:32]([C:33](=[O:34])[OH:35])[O:38][CH2:39][CH3:40])[cH:11][cH:12][c:13]1[O:14][CH2:15][CH2:16][c:17]1[cH:18][cH:19][c:20]([NH:23][C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[cH:21][cH:22]1