HRID86681

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

2 次

HCID6386

tert-Butyl alcohol

C4H10O

HCID30318

Osmium tetroxide

O4Os

HCID82029

4-Methylmorpholine 4-oxide

C5H11NO2

结构：C=Cc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2cnn(C(C)C)c2n1

HCID68294850

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C)c(CNC(=O)c2cc(C(O)CO)nc3c2cnn3C(C)C)c(=O)[nH]1

HCID68294990

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2581b347d3c44c879d8811ffafce48cb
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

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