HRID2159406

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID961

Hydroxide

HO-

HCID8857

Ethyl acetate

C4H8O2

HCID61778

Bisulfate anion

HO4S-

结构：CCCCC(NC(=O)C(Cc1ccc(O)cc1)NC(=O)OC(C)(C)C)C(=O)OC

HCID178446553

未命名化合物

PRODUCTS

生成物

结构：CCCCC(NC(=O)C(Cc1ccc(O)cc1)NC(=O)OC(C)(C)C)C(=O)O

HCID178446552

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5c11f897b79b43539d59be73e66df3d7
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

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