HRID1236814

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID531957

未命名化合物

HCID12041813

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：CN1CCC(c2c[nH]c3ccc(-c4ccc(NC(=O)c5ccc(F)cc5)cc4)cc23)CC1

HCID22626799

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-59abb5d108cf482489df3e6d429ab0d5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[Br:20][c:21]1[cH:22][cH:23][c:24]([NH:27][C:28]([c:29]2[cH:30][cH:31][c:32]([F:35])[cH:33][cH:34]2)=[O:36])[cH:25][cH:26]1.[CH3:1][N:2]1[CH2:3][CH2:4][CH:5]([c:8]2[cH:9][nH:10][c:11]3[cH:12][cH:13][c:14]([B:17]([OH:18])[OH:19])[cH:15][c:16]23)[CH2:6][CH2:7]1.[CH3:43][OH:44].[Na+:37].[Na+:38].[O-:39][C:40](=[O:41])[O-:42].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[cH:50]1[cH:51][cH:52][c:53]([P:54]([Pd:55]([P:56]([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)([c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)([P:75]([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)[P:94]([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)([c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)([c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[c:119]2[cH:120][cH:121][cH:122][cH:123][cH:124]2)[cH:125][cH:126]1>>[CH3:1][N:2]1[CH2:3][CH2:4][CH:5]([c:8]2[cH:9][nH:10][c:11]3[cH:12][cH:13][c:14](-[c:21]4[cH:22][cH:23][c:24]([NH:27][C:28]([c:29]5[cH:30][cH:31][c:32]([F:35])[cH:33][cH:34]5)=[O:36])[cH:25][cH:26]4)[cH:15][c:16]23)[CH2:6][CH2:7]1