HRID307112

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID10482

Acetyl bromide

C2H3BrO

HCID12439

2,6-Dimethylbenzoic acid

C9H10O2

结构：CCCCC(NC(=O)C(C)NC(=O)C(NC(=O)c1ccccc1)C(C)C)C(=O)O

HCID178446589

未命名化合物

PRODUCTS

生成物

HCID86755195

未命名化合物

HCID178446589

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2d6fae5496514a68b596e4e1d119e1f0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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