HRID211532

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID7965

Cyclohexylamine

C6H13N

结构：Cc1ccc(F)cc1N1CC(C)(C)N(CC(NC(=O)OC(C)(C)C)C2CC(C)C(=O)O2)CC1=O

HCID178426020

未命名化合物

HCID178516071

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(F)cc1N1CC(C)(C)N(CC(NC(=O)OC(C)(C)C)C(O)CC(C)C(=O)NC2CCCCC2)CC1=O

HCID178426021

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0fd61c767add4b7d861123b8327506a7
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

[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13]([NH:14][CH:15]([CH2:16][N:17]1[C:18]([CH3:32])([CH3:33])[CH2:19][N:20]([c:24]2[c:25]([CH3:31])[cH:26][cH:27][c:28]([F:30])[cH:29]2)[C:21](=[O:23])[CH2:22]1)[CH:34]1[O:35][C:36](=[O:40])[CH:37]([CH3:39])[CH2:38]1)=[O:41].[NH2:43][CH:44]1[CH2:45][CH2:46][CH2:47][CH2:48][CH2:49]1.[OH2:42].[OH:1][c:2]1[cH:3][cH:4][cH:5][cH:6][n:7]1>>[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13]([NH:14][CH:15]([CH2:16][N:17]1[C:18]([CH3:32])([CH3:33])[CH2:19][N:20]([c:24]2[c:25]([CH3:31])[cH:26][cH:27][c:28]([F:30])[cH:29]2)[C:21](=[O:23])[CH2:22]1)[CH:34]([OH:35])[CH2:38][CH:37]([C:36](=[O:40])[NH:43][CH:44]1[CH2:45][CH2:46][CH2:47][CH2:48][CH2:49]1)[CH3:39])=[O:41]