HRID2320251

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID1135

Thymine

C5H6N2O2

HCID6342

Acetonitrile

C2H3N

HCID24287

Tetrachlorostannane

Cl4Sn

结构：CC(=O)OC1OC(COC(=O)c2ccccc2)C(C)(OC(C)=O)C1(C)F

HCID178475789

未命名化合物

PRODUCTS

生成物

结构：CC(=O)OC1(C)C(COC(=O)c2ccccc2)OC(n2cc(C)c(=O)[nH]c2=O)C1(C)F

HCID178475441

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bff35c3459b841e794b39c74e793f1b3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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