HRID1223061

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID141077

N,N-Dimethyl p-fluorobenzamide

C9H10FNO

HCID25067321

tert-Butyl 4-hydroxy-2-(hydroxymethyl)-2,3-dihydro-1-benzofuran-6-carboxylate

C14H18O5

结构：COC(=O)c1cc(Oc2ccc(S(C)(=O)=O)cc2)cc2c1CC(C)O2

HCID59560437

未命名化合物

PRODUCTS

生成物

结构：CN(C)C(=O)c1ccc(Oc2cc(C(=O)OC(C)(C)C)cc3c2CC(CO)O3)cc1

HCID59560128

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-efdc7c3de9874cffbeff09fb86ff0985
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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