HRID133911

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

HCID89719

Methyl (2-hydroxyphenyl)acetate

C9H10O3

HCID166653

Hydride

H-

HCID10881551

未命名化合物

PRODUCTS

生成物

结构：COC(=O)Cc1ccccc1OCc1cccc(OCc2nc(-c3ccccc3)oc2C)c1

HCID68884503

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-14a2c7c8f22a43c58a16db59472fa8e0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH3:35][N:36]([CH3:37])[CH:38]=[O:39].[Cl:1][CH2:2][c:3]1[cH:4][c:5]([O:6][CH2:7][c:8]2[n:9][c:10](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[o:11][c:12]2[CH3:13])[cH:20][cH:21][cH:22]1.[H-:40].[Na+:41].[OH2:42].[OH:23][c:24]1[c:25]([CH2:30][C:31](=[O:32])[O:33][CH3:34])[cH:26][cH:27][cH:28][cH:29]1>>[CH2:2]([c:3]1[cH:4][c:5]([O:6][CH2:7][c:8]2[n:9][c:10](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[o:11][c:12]2[CH3:13])[cH:20][cH:21][cH:22]1)[O:23][c:24]1[c:25]([CH2:30][C:31](=[O:32])[O:33][CH3:34])[cH:26][cH:27][cH:28][cH:29]1