HRID317603

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3496445

未命名化合物

结构：CC(C)(C)OC(=O)N1CCn2c(C(=O)c3ccccc3)nc(C(=O)O)c2C1

HCID57635676

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)C(NC(=O)c1nc(C(=O)c2ccccc2)n2c1CN(C(=O)OC(C)(C)C)CC2)C(C)(C)C

HCID66932090

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-60f06b115a924ac59b668153789f36a7
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

[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[n:10][c:11]([C:25](=[O:26])[OH:27])[c:12]2[n:13]1[CH2:14][CH2:15][N:16]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:17]2.[CH3:28][NH:29][C:30]([CH:31]([NH2:32])[C:33]([CH3:34])([CH3:35])[CH3:36])=[O:37]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[n:10][c:11]([C:25](=[O:27])[NH:32][CH:31]([C:30]([NH:29][CH3:28])=[O:37])[C:33]([CH3:34])([CH3:35])[CH3:36])[c:12]2[n:13]1[CH2:14][CH2:15][N:16]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:17]2