HRID677938

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID75077

Methyl dihydroxybenzoate

C8H8O4

HCID23432399

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cc(OCCCCCCOc2ccc(-c3ccccc3)cc2)ccc1O

HCID54513465

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4effadabdc3642ea8008076f9f5dd6dc
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:33](=[O:34])([O-:35])[O-:36].[CH3:1][O:2][C:3]([c:4]1[c:5]([OH:11])[cH:6][cH:7][c:8]([OH:10])[cH:9]1)=[O:12].[CH3:39][C:40](=[O:41])[CH3:42].[K+:37].[K+:38].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[c:13]1(-[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:14][cH:15][c:16]([O:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][Br:26])[cH:17][cH:18]1>>[CH3:1][O:2][C:3]([c:4]1[c:5]([OH:11])[cH:6][cH:7][c:8]([O:10][CH2:25][CH2:24][CH2:23][CH2:22][CH2:21][CH2:20][O:19][c:16]2[cH:15][cH:14][c:13](-[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[cH:18][cH:17]2)[cH:9]1)=[O:12]