HRID2154733

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

结构：COc1ccc(Cn2cc(-c3cc(Cc4ccc(F)cc4)n(CC(=O)OC(C)(C)C)n3)nn2)cc1

HCID68360285

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(Cn2cc(-c3cc(Cc4ccc(F)cc4)n(CC(=O)O)n3)nn2)cc1

HCID67092066

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8ef9c29f57fb400da22f77e8dc04d01c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:36][OH:37].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][c:7]2[cH:8][c:9](-[c:20]3[n:21][n:22][n:23]([CH2:25][c:26]4[cH:27][cH:28][c:29]([O:32][CH3:33])[cH:30][cH:31]4)[cH:24]3)[n:10][n:11]2[CH2:12][C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[cH:34][cH:35]1.[Na+:44].[OH-:43].[OH2:45]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][c:7]2[cH:8][c:9](-[c:20]3[n:21][n:22][n:23]([CH2:25][c:26]4[cH:27][cH:28][c:29]([O:32][CH3:33])[cH:30][cH:31]4)[cH:24]3)[n:10][n:11]2[CH2:12][C:13](=[O:14])[OH:15])[cH:34][cH:35]1