HRID702724

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7183041

1-methyl-4,4'-bipiperidine

C11H22N2

结构：Cc1cc(CC(OC(=O)N2CCC(N3CCc4ccccc4NC3=O)CC2)C(=O)O)cc(C)c1O

HCID67273813

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(CC(OC(=O)N2CCC(N3CCc4ccccc4NC3=O)CC2)C(=O)N2CCC(C3CCN(C)CC3)CC2)cc(C)c1O

HCID178425745

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7df076a8f5fe42bda27d179ae06ecf7f
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

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