HRID1211007

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

结构：CC(C)(C)OC(=O)n1nc(-c2cc3cc(C=O)ccc3n2C(=O)OC(C)(C)C)c2sccc21

HCID57637335

未命名化合物

HCID178418255

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)n1nc(-c2cc3cc(C(O)c4ccccc4)ccc3n2C(=O)OC(C)(C)C)c2sccc21

HCID57637278

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-57c371607f314767a6814f0589a45fc5
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

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