HRID2335377

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6212

Chloroform

CHCl3

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

HCID22125219

未命名化合物

HCID22125386

未命名化合物

PRODUCTS

生成物

结构：CN1C(=O)CCC2(C)c3ccc(-c4cc(C(C)(C)C)c(O)c(C(C)(C)C)c4)cc3CCC12

HCID178481402

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1ca8a506f7944ddc9ded9837365975d8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:19]([CH3:20])([CH3:21])([CH3:22])[c:23]1[cH:24][c:25]([B:34]([OH:35])[OH:36])[cH:26][c:27]([C:30]([CH3:31])([CH3:32])[CH3:33])[c:28]1[OH:29].[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[CH3:1][N:2]1[C:3](=[O:18])[CH2:4][CH2:5][C:6]2([CH3:17])[c:7]3[c:8]([cH:12][c:13]([Br:16])[cH:14][cH:15]3)[CH2:9][CH2:10][CH:11]12.[CH:48]([Cl:49])([Cl:50])[Cl:51].[Na+:37].[Na+:38].[O-:39][C:40](=[O:41])[O-:42].[Pd:52].[c:110]1([P:111]([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][cH:126][cH:127][cH:128]1.[c:53]1([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68][cH:69][cH:70][cH:71]1.[c:72]1([P:73]([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[cH:86][cH:87][cH:88][cH:89][cH:90]1.[c:91]1([P:92]([c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)[c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)[cH:105][cH:106][cH:107][cH:108][cH:109]1>>[CH3:1][N:2]1[C:3](=[O:18])[CH2:4][CH2:5][C:6]2([CH3:17])[c:7]3[c:8]([cH:12][c:13](-[c:25]4[cH:24][c:23]([C:19]([CH3:20])([CH3:21])[CH3:22])[c:28]([OH:29])[c:27]([C:30]([CH3:31])([CH3:32])[CH3:33])[cH:26]4)[cH:14][cH:15]3)[CH2:9][CH2:10][CH:11]12