HRID199505

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

2 次

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID312183

4-Boronobenzoic acid

C7H7BO4

HCID11483086

1,4-Dioxaspiro[4.5]dec-7-en-8-yl trifluoromethanesulfonate

C9H11F3O5S

PRODUCTS

生成物

HCID59556095

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7d412f6dae2c4524a3e88058057f7067
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

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