HRID1134733

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8071

未命名化合物

HCID78412

Phenyl dihydrogen orthoborate

C6H7BO3

HCID19367128

未命名化合物

HCID178420554

未命名化合物

PRODUCTS

产物

HCID19367100

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-bd63c25d01f94fe29127b4c52cf0e6d4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5]2[n:6]([cH:7]1)[cH:8][c:9]([CH2:11][N:12]1[CH2:13][CH2:14][N:15]([c:18]3[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]3)[CH2:16][CH2:17]1)[n:10]2.[C:41](=[O:42])([OH:43])[O-:44].[CH2:25]([CH2:26][O:27][CH3:28])[O:29][CH3:30].[Na+:45].[OH2:46].[c:31]1([O:37][B:38]([OH:39])[OH:40])[cH:32][cH:33][cH:34][cH:35][cH:36]1.[cH:47]1[cH:48][cH:49][c:50]([P:51]([Pd:52]([P:53]([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)[c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)([P:72]([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)[c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)[P:91]([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)[c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)[cH:122][cH:123]1>>[c:2]1(-[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[cH:3][cH:4][c:5]2[n:6]([cH:7]1)[cH:8][c:9]([CH2:11][N:12]1[CH2:13][CH2:14][N:15]([c:18]3[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]3)[CH2:16][CH2:17]1)[n:10]2