HRID663957

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID24841

Hydrogen iodide

HCID67184

1-Bromopyrrolidine-2,5-dione

C4H4BrNO2

HCID104748

Sulfurous acid, ion(1-)

HO3S-

HCID60134425

未命名化合物

HCID69462366

未命名化合物

PRODUCTS

生成物

结构：CC(C)(CSSCC(C)(C)NC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1

HCID86606846

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fede6cd6a93a40f09cbbf667427612d6
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

[Br:19][N:20]1[C:21](=[O:22])[CH2:23][CH2:24][C:25]1=[O:26].[C:32]([O:33][CH2:34][S:37][CH2:38][C:39]([CH3:40])([CH3:41])[NH:42][C:43](=[O:44])[O:45][CH2:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1)(=[O:35])[CH3:36].[CH3:1][C:2]([CH2:3][S:4][CH3:5])([CH3:6])[NH:7][C:8]([O:9][CH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)=[O:17].[CH3:59][OH:60].[I:53].[Na+:27].[Na+:54].[OH2:18].[OH:28][C:29](=[O:30])[O-:31].[OH:55][S:56](=[O:57])[O-:58]>>[CH3:1][C:2]([CH2:3][S:4][S:37][CH2:38][C:39]([CH3:40])([CH3:41])[NH:42][C:43](=[O:44])[O:45][CH2:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1)([CH3:6])[NH:7][C:8]([O:9][CH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)=[O:17]