HRID2340170

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID66048

4-Piperidinol, 1-methyl-

C6H13NO

HCID75555

未命名化合物

结构：CC(C)(C)OC(=O)c1ccc(-c2ccccc2)cc1NC(=O)c1cc(O)ccc1OCc1ccccc1

HCID66990772

未命名化合物

PRODUCTS

生成物

结构：CN1CCC(Oc2ccc(OCc3ccccc3)c(C(=O)Nc3cc(-c4ccccc4)ccc3C(=O)OC(C)(C)C)c2)CC1

HCID66991124

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2e453d7ef33d4ab0ae31edd2c509e2a3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:42]([c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1)[O:49][c:50]1[c:51]([C:52](=[O:53])[NH:54][c:55]2[c:56]([C:57](=[O:58])[O:59][C:60]([CH3:61])([CH3:62])[CH3:63])[cH:64][cH:65][c:66](-[c:68]3[cH:69][cH:70][cH:71][cH:72][cH:73]3)[cH:67]2)[cH:74][c:75]([OH:78])[cH:76][cH:77]1.[O:28]=[C:29]([O:30][CH:31]([CH3:32])[CH3:33])[N:34]=[N:35][C:36]([O:37][CH:38]([CH3:39])[CH3:40])=[O:41].[O:79]1[CH2:80][CH2:81][CH2:82][CH2:83]1.[OH:1][CH:2]1[CH2:3][CH2:4][N:5]([CH3:8])[CH2:6][CH2:7]1.[c:9]1([P:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[O:1]([CH:2]1[CH2:3][CH2:4][N:5]([CH3:8])[CH2:6][CH2:7]1)[c:75]1[cH:74][c:51]([C:52](=[O:53])[NH:54][c:55]2[c:56]([C:57](=[O:58])[O:59][C:60]([CH3:61])([CH3:62])[CH3:63])[cH:64][cH:65][c:66](-[c:68]3[cH:69][cH:70][cH:71][cH:72][cH:73]3)[cH:67]2)[c:50]([O:49][CH2:42][c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[cH:77][cH:76]1