HRID1547001

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3283

Diethyl Ether

C4H10O

结构：CCOC(=O)CC(O)CC(O)C=Cc1c(-c2ccccc2)c2c3ccccc3ccn2c1C(C)C

HCID54006007

未命名化合物

PRODUCTS

生成物

HCID53844765

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-34b21ff599ed4e58a699a4bba6504b9a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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