HRID2152929

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

HCID6212

Chloroform

CHCl3

结构：CC(Cc1ccc2c(c1)OC(C(=O)OCC(C)(C)C)(C(=O)OCC(C)(C)C)O2)NCC(O)c1cccc(Cl)c1

HCID9829304

未命名化合物

PRODUCTS

生成物

结构：CC(Cc1ccc2c(c1)OC(C(=O)O)(C(=O)OCC(C)(C)C)O2)NCC(O)c1cccc(Cl)c1

HCID178438422

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fa9767a376e94fb2b54c249ebc50ed4b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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