HRID1139210

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

结构：COC(=O)CCc1cc(C(CC(C)C)NC(=O)Cc2ccc(NC(=O)Nc3ccccc3C)cc2)no1

HCID18682368

未命名化合物

PRODUCTS

生成物

结构：Cc1ccccc1NC(=O)Nc1ccc(CC(=O)NC(CC(C)C)c2cc(CCC(=O)O)on2)cc1

HCID9935407

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-889b122fe9044d078b5b837c14b83056
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

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