HRID688160

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID529392

3-Oxotetrahydrofuran

C4H6O2

结构：Cc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(CC3CNC3)n(C)c2n1

HCID59605459

未命名化合物

PRODUCTS

生成物

结构：Cc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(CC3CN(C4CCOC4)C3)n(C)c2n1

HCID59605293

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-95869df9aa064925838904a4933a8be9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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