HRID196752

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID43373003

4-Methoxy-1,4'-bipiperidine

C11H22N2O

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：COC1CCN(C2CCN(C(=O)C(Cc3cc(C)c(O)c(C)c3)OC(=O)N3CCC(N4CCc5ccccc5NC4=O)CC3)CC2)CC1

HCID178493058

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-564034594a384a8681d20b155943cf1b
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

[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:43][O:44][CH:45]1[CH2:46][CH2:47][N:48]([CH:51]2[CH2:52][CH2:53][NH:54][CH2:55][CH2:56]2)[CH2:49][CH2:50]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:31])[N:54]2[CH2:53][CH2:52][CH:51]([N:48]3[CH2:47][CH2:46][CH:45]([O:44][CH3:43])[CH2:50][CH2:49]3)[CH2:56][CH2:55]2)[CH2:13][CH2:14]1