HRID1142212

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID108794

2-Iodoxybenzoic acid

C7H5IO4

结构：CCONC(=O)C(O)C(Cc1ccccc1)NC(=O)C1CCC(=O)N1Cc1ccccc1

HCID87325800

未命名化合物

PRODUCTS

生成物

HCID53257549

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-71c3f1cee6684e9ababaee398b8a237c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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