HRID2140146

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID8028

Tetrahydrofuran

C4H8O

HCID68979882

未命名化合物

PRODUCTS

产物

HCID68654388

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-061c313d6b3445bfad8d0fb6c77b2b69
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

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