HRID1557115

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8071

未命名化合物

HCID19660

Carbonate Ion

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID44248997

2-(3-Boronophenyl)-2-methylpropanoic acid

C10H13BO4

HCID86240121

未命名化合物

HCID178420554

未命名化合物

PRODUCTS

产物

HCID53321679

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-7fa31f2275ef46bab4eb9ab5d7daf73b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应SMILES

[C:21](=[O:22])([OH:23])[C:24]([CH3:25])([CH3:26])[c:27]1[cH:28][c:29]([B:33]([OH:34])[OH:35])[cH:30][cH:31][cH:32]1.[C:36](=[O:37])([O-:38])[O-:39].[CH3:42][O:43][CH2:44][CH2:45][O:46][CH3:47].[Cl:1][c:2]1[cH:3][c:4]([NH:10][CH2:11][C:12]([c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)([F:19])[F:20])[n:5][c:6]([O:8][CH3:9])[n:7]1.[Cs+:40].[Cs+:41].[OH2:48].[cH:49]1[cH:50][cH:51][c:52]([P:53]([Pd:54]([P:55]([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)[c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)([P:74]([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)[c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[P:93]([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)[c:118]2[cH:119][cH:120][cH:121][cH:122][cH:123]2)[cH:124][cH:125]1>>[c:2]1(-[c:29]2[cH:28][c:27]([C:24]([C:21](=[O:22])[OH:23])([CH3:25])[CH3:26])[cH:32][cH:31][cH:30]2)[cH:3][c:4]([NH:10][CH2:11][C:12]([c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)([F:19])[F:20])[n:5][c:6]([O:8][CH3:9])[n:7]1