HRID177370

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID19660

Carbonate

CO3-2

HCID2734378

3-Pyridinylboronic acid

C5H6BNO2

结构：COc1cc(-c2nc3ccccc3o2)ccc1OS(=O)(=O)C(F)(F)F

HCID21990989

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

HCID10171785

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-698a1ae408d54bd5ab3bb49baafb0d84
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

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