HRID188757

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID7301

2-Methyltetrahydrofuran

C5H10O

HCID204484

Propylphosphonic acid

C3H9O3P

HCID44176226

5-Amino-2,4-di-tert-butylphenol

C14H23NO

HCID66859447

未命名化合物

PRODUCTS

生成物

结构：CCc1cc2[nH]cc(C(=O)Nc3cc(O)c(C(C)(C)C)cc3C(C)(C)C)c(=O)n2c1

HCID42642292

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6a66f82eb1c045ea9d02dad0544756b0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:16]([P:17]([OH:18])(=[O:19])[OH:20])[CH2:21][CH3:22].[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]2[n:6]([c:7](=[O:14])[c:8]([C:11](=[O:12])[OH:13])[cH:9][nH:10]2)[cH:15]1.[CH3:45][CH:46]1[CH2:47][CH2:48][CH2:49][O:50]1.[NH2:29][c:30]1[c:31]([C:41]([CH3:42])([CH3:43])[CH3:44])[cH:32][c:33]([C:37]([CH3:38])([CH3:39])[CH3:40])[c:34]([OH:36])[cH:35]1.[cH:23]1[cH:24][cH:25][n:26][cH:27][cH:28]1>>[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]2[n:6]([c:7](=[O:14])[c:8]([C:11](=[O:13])[NH:29][c:30]3[c:31]([C:41]([CH3:42])([CH3:43])[CH3:44])[cH:32][c:33]([C:37]([CH3:38])([CH3:39])[CH3:40])[c:34]([OH:36])[cH:35]3)[cH:9][nH:10]2)[cH:15]1