HRID700498

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID14459854

N,N-Dimethylpiperidin-3-amine

C7H16N2

结构：CCc1ccc(CC(NC(=O)N2CCC(N3CCc4ccccc4NC3=O)CC2)C(=O)O)cc1CC

HCID22184578

未命名化合物

PRODUCTS

生成物

结构：CCc1ccc(CC(NC(=O)N2CCC(N3CCc4ccccc4NC3=O)CC2)C(=O)N2CCCC(N(C)C)C2)cc1CC

HCID178436288

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1b667a0edee040cd9b8b8c8403375796
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

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