HRID694701

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

结构：CC(C)(C)OC(=O)C1CC2CCCCC2N1C(=O)C(NC(=O)C(NC(=O)OCc1ccccc1)C1CCCCC1)C(C)(C)C

HCID68494211

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)C1CC2CCCCC2N1C(=O)C(NC(=O)C(N)C1CCCCC1)C(C)(C)C

HCID68496924

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-674623bf2fb14e1bb25854ff05ca7377
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

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