HRID196834

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID68843

2,6-Lupetidine

C7H15N

结构：CC(C)N1CCC(NC(=O)c2nc3c(C(=O)O)cccc3n2CC(=O)Nc2ccc(Cl)cn2)CC1

HCID11375453

未命名化合物

PRODUCTS

生成物

结构：CC(C)N1CCC(NC(=O)c2nc3c(C(=O)N4C(C)CCCC4C)cccc3n2CC(=O)Nc2ccc(Cl)cn2)CC1

HCID67012896

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f8ec20e5731d4ec2af25a83c705df9b2
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][CH:37]1[NH:38][CH:39]([CH3:43])[CH2:40][CH2:41][CH2:42]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9](=[O:10])[CH2:11][n:12]2[c:13]([C:24]([NH:25][CH:26]3[CH2:27][CH2:28][N:29]([CH:32]([CH3:33])[CH3:34])[CH2:30][CH2:31]3)=[O:35])[n:14][c:15]3[c:16]2[cH:17][cH:18][cH:19][c:20]3[C:21](=[O:22])[OH:23])[n:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9](=[O:10])[CH2:11][n:12]2[c:13]([C:24]([NH:25][CH:26]3[CH2:27][CH2:28][N:29]([CH:32]([CH3:33])[CH3:34])[CH2:30][CH2:31]3)=[O:35])[n:14][c:15]3[c:16]2[cH:17][cH:18][cH:19][c:20]3[C:21](=[O:22])[N:38]2[CH:37]([CH3:36])[CH2:42][CH2:41][CH2:40][CH:39]2[CH3:43])[n:6][cH:7]1