HRID2145802

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID100621

2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate

C18H25NO3

HCID5166119

2-[(tert-Butoxycarbonyl)amino]pent-4-enoic acid

C10H17NO4

HCID69659486

未命名化合物

PRODUCTS

生成物

结构：C=CCC(NC(=O)OC(C)(C)C)C(=O)N1C(CC=C)CCCC1C(=O)OC

HCID69659809

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f4933ff7aafc4ca5a8bc5452cd7652a5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:14]([CH3:15])([CH3:16])([CH3:17])[O:18][C:19](=[O:20])[NH:21][CH:22]([C:23](=[O:24])[OH:25])[CH2:26][CH:27]=[CH2:28].[CH2:29]([O:30][CH:31]1[CH:32]=[CH:33][c:34]2[c:35]([cH:36][cH:37][cH:38][cH:39]2)[N:40]1[C:41]([O:42][CH2:43][CH:44]([CH3:45])[CH3:46])=[O:47])[CH:48]([CH3:49])[CH3:50].[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[CH3:1][O:2][C:3](=[O:4])[CH:5]1[NH:6][CH:7]([CH2:11][CH:12]=[CH2:13])[CH2:8][CH2:9][CH2:10]1.[CH3:56][CH2:57][O:58][C:59]([CH3:60])=[O:61]>>[CH3:1][O:2][C:3](=[O:4])[CH:5]1[N:6]([C:23]([CH:22]([NH:21][C:19]([O:18][C:14]([CH3:15])([CH3:16])[CH3:17])=[O:20])[CH2:26][CH:27]=[CH2:28])=[O:24])[CH:7]([CH2:11][CH:12]=[CH2:13])[CH2:8][CH2:9][CH2:10]1