HRID1571896

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID24290

未命名化合物

HCID72874

4-Iodosalicylic acid

C7H5IO3

HCID83717

Copper iodide (CuI2)

CuI2

HCID86646573

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1cc(C(O)C#Cc2ccc(C(=O)O)c(O)c2)cc(C(C)C)c1N(C)C

HCID25109559

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-80a8461c8e8d4dda8f40abe6fb749c18
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

[CH3:12][N:13]([c:14]1[c:15]([CH:27]([CH3:28])[CH3:29])[cH:16][c:17]([CH:23]([C:24]#[CH:25])[OH:26])[cH:18][c:19]1[CH:20]([CH3:21])[CH3:22])[CH3:30].[Cu:31]([I:32])[I:33].[OH:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][cH:8][c:9]([I:11])[cH:10]1.[Pd:34]([Cl:35])[Cl:36].[c:37]1([P:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:51][cH:52][cH:53][cH:54][cH:55]1.[c:56]1([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[cH:70][cH:71][cH:72][cH:73][cH:74]1>>[OH:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][cH:8][c:9]([C:25]#[C:24][CH:23]([c:17]2[cH:16][c:15]([CH:27]([CH3:28])[CH3:29])[c:14]([N:13]([CH3:12])[CH3:30])[c:19]([CH:20]([CH3:21])[CH3:22])[cH:18]2)[OH:26])[cH:10]1