HRID959615

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID8028

Tetrahydrofuran

C4H8O

结构：COC(=O)C(C)(C)c1ccc(C#Cc2ccc3c(c2)C(C)(C)CCC3N(C)C2CC2)cc1

HCID69069553

未命名化合物

PRODUCTS

生成物

结构：CN(C1CC1)C1CCC(C)(C)c2cc(C#Cc3ccc(C(C)(C)C(=O)O)cc3)ccc21

HCID11395905

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-74f134189e9047c491ba7e632d3b7e65
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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