HRID676516

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID784

Hydrogen peroxide

H2O2

HCID923

Sodium ion

Na+

3 次

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID1099

Sulfite

O3S-2

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID28486

Lithium ion

Li+

HCID104748

Sulfurous acid, ion(1-)

HO3S-

结构：CCCC(C)CC(CC(=O)OC(C)(C)C)C(=O)N1C(=O)OC(c2ccccc2)C1C

HCID178443538

未命名化合物

PRODUCTS

生成物

HCID21943581

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4537aa6aea16491a8eac7eda81dbd0b4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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