HRID1538270

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID11776

Triphenylphosphine

C18H15P

HCID13181

Pent-4-en-1-ol

C5H10O

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID105144

Palladium(2+)

Pd+2

HCID19017116

未命名化合物

PRODUCTS

生成物

HCID54006370

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-132121b8163b485a873d8ca287dc68c3
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

[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][cH:10][c:11]([O:14][CH2:15][CH3:16])[cH:12][n:13]2)[cH:6][cH:7]1.[C:23](=[O:24])([OH:25])[O-:26].[C:47]([O-:48])(=[O:49])[CH3:50].[C:52]([O-:53])(=[O:54])[CH3:55].[CH2:17]([CH2:18][CH2:19][CH:20]=[CH2:21])[OH:22].[CH3:57][N:58]1[CH2:59][CH2:60][CH2:61][C:62]1=[O:63].[Na+:27].[OH2:56].[Pd+2:51].[c:28]1([P:29]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:42][cH:43][cH:44][cH:45][cH:46]1>>[c:2]1([CH:21]=[CH:20][CH2:19][CH2:18][CH2:17][OH:22])[cH:3][cH:4][c:5](-[c:8]2[n:9][cH:10][c:11]([O:14][CH2:15][CH3:16])[cH:12][n:13]2)[cH:6][cH:7]1