HRID214751

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID10588171

Benzene, 1-(6-bromohexyl)-4-methoxy-

C13H19BrO

结构：COCc1c(C(=O)OC(C)C)ncc2[nH]c3cccc(OCc4ccccc4)c3c12

HCID54138590

未命名化合物

PRODUCTS

生成物

结构：COCc1c(C(=O)OC(C)C)ncc2c1c1c(OCc3ccccc3)cccc1n2CCCCCCc1ccc(OC)cc1

HCID67595562

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e63c0a64622240f7a3ce4aec38345534
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

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