HRID961269

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID769

Bicarbonate Ion

CHO3-

HCID813

Potassium cation

K+

2 次

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

结构：CC(=O)OCC1OC(Br)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

HCID102932

未命名化合物

HCID124611

Tributylbenzylammonium

C19H34N+

HCID54704139

N-Benzyl-3-hydroxythiophene-2-carboxamide

C12H11NO2S

PRODUCTS

生成物

结构：CC(=O)OCC1OC(Oc2ccsc2C(=O)NCc2ccccc2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

HCID21961241

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-64cf8873cb4e493181bad3ae67954555
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:17]([CH3:18])(=[O:19])[O:20][CH:21]1[CH:22]([Br:40])[O:23][CH:24]([CH2:35][O:36][C:37]([CH3:38])=[O:39])[CH:25]([O:31][C:32]([CH3:33])=[O:34])[CH:26]1[O:27][C:28]([CH3:29])=[O:30].[C:41](=[O:42])([O-:43])[O-:44].[C:47](=[O:48])([OH:49])[O-:50].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[c:11]1[s:12][cH:13][cH:14][c:15]1[OH:16].[CH2:53]([N+:54]([CH2:55][CH2:56][CH2:57][CH3:58])([CH2:59][CH2:60][CH2:61][CH3:62])[CH2:63][CH2:64][CH2:65][CH3:66])[c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1.[Cl-:52].[Cl:73][CH2:74][Cl:75].[K+:45].[K+:46].[Na+:51].[OH2:76]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[c:11]1[s:12][cH:13][cH:14][c:15]1[O:16][CH:22]1[CH:21]([O:20][C:17]([CH3:18])=[O:19])[CH:26]([O:27][C:28]([CH3:29])=[O:30])[CH:25]([O:31][C:32]([CH3:33])=[O:34])[CH:24]([CH2:35][O:36][C:37]([CH3:38])=[O:39])[O:23]1