HRID290620

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID11040

Methyl 2-hydroxypropanoate

C4H8O3

HCID11776

Triphenylphosphine

C18H15P

结构：Oc1cccc2ncnc(Nc3ccc4c(cnn4Cc4ccccn4)c3)c12

HCID136346719

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(C)Oc1cccc2ncnc(Nc3ccc4c(cnn4Cc4ccccn4)c3)c12

HCID178500874

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9c4980f042254c16be7044f82fd919cc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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