HRID284909

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID68511

5-Bromo-2-furanecarboxylic acid

C5H3BrO3

结构：COc1c(B2OC(C)(C)C(C)(C)O2)cc(C)cc1[N+](=O)[O-]

HCID57483818

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：COc1c(-c2ccc(C(=O)O)o2)cc(C)cc1[N+](=O)[O-]

HCID57483835

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-15335fbd21f247758ac4484b57424f69
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:28][c:29]1[cH:30][cH:31][c:32]([C:34](=[O:35])[OH:36])[o:33]1.[CH2:1]1[O:2][CH2:3][CH2:4][O:5][CH2:6]1.[CH3:7][O:8][c:9]1[c:10]([B:19]2[O:20][C:21]([CH3:22])([CH3:23])[C:24]([CH3:25])([CH3:26])[O:27]2)[cH:11][c:12]([CH3:18])[cH:13][c:14]1[N+:15](=[O:16])[O-:17].[Na+:37].[Na+:38].[O-:39][C:40](=[O:41])[O-:42].[OH2:120].[cH:43]1[cH:44][cH:45][c:46]([P:47]([Pd:48]([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([P:68]([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[P:87]([c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)[c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)([c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)[cH:118][cH:119]1>>[CH3:7][O:8][c:9]1[c:10](-[c:29]2[cH:30][cH:31][c:32]([C:34](=[O:35])[OH:36])[o:33]2)[cH:11][c:12]([CH3:18])[cH:13][c:14]1[N+:15](=[O:16])[O-:17]