HRID1206042

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID962

Water

H2O

结构：Cc1c(C=O)c2c(c(C)c1NC(=O)CC(C)(C)C)C(c1ccc(C(C)C)cc1)CO2

HCID23114128

未命名化合物

HCID178455847

未命名化合物

PRODUCTS

生成物

结构：CCCC(O)c1c(C)c(NC(=O)CC(C)(C)C)c(C)c2c1OCC2c1ccc(C(C)C)cc1

HCID23113962

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c3d892ec2d5b43648112f3fcfeb99b03
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:2]([CH2:3][CH3:4])[Mg+:5].[CH:6](=[O:7])[c:8]1[c:9]([CH3:35])[c:10]([NH:27][C:28]([CH2:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[c:11]([CH3:26])[c:12]2[c:16]1[O:15][CH2:14][CH:13]2[c:17]1[cH:18][cH:19][c:20]([CH:23]([CH3:24])[CH3:25])[cH:21][cH:22]1.[Cl-:1].[OH2:36]>>[CH2:2]([CH2:3][CH3:4])[CH:6]([OH:7])[c:8]1[c:9]([CH3:35])[c:10]([NH:27][C:28]([CH2:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[c:11]([CH3:26])[c:12]2[c:16]1[O:15][CH2:14][CH:13]2[c:17]1[cH:18][cH:19][c:20]([CH:23]([CH3:24])[CH3:25])[cH:21][cH:22]1