HRID126355

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID888

Magnesium cation

Mg+2

HCID71440607

未命名化合物

结构：C=CC(CC(CNC(=O)c1ccccc1OCCCOC)C(C)C)NC(=O)OC(C)(C)C

HCID91344097

未命名化合物

PRODUCTS

生成物

结构：COCCCOc1ccccc1C(=O)NCC(CC(NC(=O)OC(C)(C)C)C1CO1)C(C)C

HCID178495325

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-41791c7cfabb44238a3a213ea52b5d4f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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