HRID181226

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

结构：CC(C)c1c(Cc2ccccc2)c(OC2OC(COC(=O)C(C)(C)C)C(OC(=O)C(C)(C)C)C(OC(=O)C(C)(C)C)C2OC(=O)C(C)(C)C)nn1C(=O)OCc1ccccc1

HCID178438778

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1[nH]nc(OC2OC(COC(=O)C(C)(C)C)C(OC(=O)C(C)(C)C)C(OC(=O)C(C)(C)C)C2OC(=O)C(C)(C)C)c1Cc1ccccc1

HCID178440280

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3935ee1ba501427893db5ad839d3a49d
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

[CH2:1]([O:2][C:3](=[O:4])[n:11]1[n:12][c:13]([O:26][CH:27]2[CH:28]([O:29][C:30]([C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH:36]([O:37][C:38]([C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[CH:44]([O:45][C:46]([C:47]([CH3:48])([CH3:49])[CH3:50])=[O:51])[CH:52]([CH2:54][O:55][C:56]([C:57]([CH3:58])([CH3:59])[CH3:60])=[O:61])[O:53]2)[c:14]([CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[c:15]1[CH:16]([CH3:17])[CH3:18])[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[CH3:62][OH:63]>>[nH:11]1[n:12][c:13]([O:26][CH:27]2[CH:28]([O:29][C:30]([C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH:36]([O:37][C:38]([C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[CH:44]([O:45][C:46]([C:47]([CH3:48])([CH3:49])[CH3:50])=[O:51])[CH:52]([CH2:54][O:55][C:56]([C:57]([CH3:58])([CH3:59])[CH3:60])=[O:61])[O:53]2)[c:14]([CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[c:15]1[CH:16]([CH3:17])[CH3:18]