HRID1122707

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID15455

Tetraethyl methylenebis(phosphonate)

C9H22O6P2

HCID166653

Hydride

H-

结构：Cc1oc(-c2ccco2)nc1COc1ccc(COc2nn(-c3ccccc3)cc2C=O)cc1

HCID86605779

未命名化合物

PRODUCTS

生成物

结构：CCOP(=O)(C=Cc1cn(-c2ccccc2)nc1OCc1ccc(OCc2nc(-c3ccco3)oc2C)cc1)OCC

HCID90833583

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fddc3ab9613349089ad1c5c8544458e6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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