HRID179425

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID813

Potassium cation

K+

HCID24401

Permanganate Ion

MnO4-

结构：COc1cccc(Oc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)nc(C=O)nc2OCCOC(C)=O)c1

HCID57295961

未命名化合物

PRODUCTS

生成物

结构：COc1cccc(Oc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)nc(C(=O)O)nc2OCCOC(C)=O)c1

HCID57261350

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c02030727aa14a9391fb64ab28f158ab
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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