HRID149713

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8028

Tetrahydrofuran

C4H8O

结构：CCCc1c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2)c(=O)n(C2CCC3(CC2)OCCO3)c2nc(C)nn12

HCID136063847

未命名化合物

PRODUCTS

生成物

结构：CCCc1c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2)c(=O)n(C2CCC(=O)CC2)c2nc(C)nn12

HCID136063716

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-df866faadb07455ca1a213ed6914be69
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[ClH:44].[O:1]1[CH2:3][CH2:2][O:4][C:5]12[CH2:6][CH2:7][CH:8]([n:11]1[c:12]3[n:13]([c:14]([CH2:37][CH2:38][CH3:39])[c:15]([CH2:18][c:19]4[cH:20][cH:21][c:22](-[c:25]5[c:26](-[c:31]6[n:32][o:33][c:34](=[O:36])[nH:35]6)[cH:27][cH:28][cH:29][cH:30]5)[cH:23][cH:24]4)[c:16]1=[O:17])[n:40][c:41]([CH3:43])[n:42]3)[CH2:9][CH2:10]2.[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1>>[O:4]=[C:5]1[CH2:6][CH2:7][CH:8]([n:11]2[c:12]3[n:13]([c:14]([CH2:37][CH2:38][CH3:39])[c:15]([CH2:18][c:19]4[cH:20][cH:21][c:22](-[c:25]5[c:26](-[c:31]6[n:32][o:33][c:34](=[O:36])[nH:35]6)[cH:27][cH:28][cH:29][cH:30]5)[cH:23][cH:24]4)[c:16]2=[O:17])[n:40][c:41]([CH3:43])[n:42]3)[CH2:9][CH2:10]1