HRID297627

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

HCID1049

Pyridine

C5H5N

HCID8857

Ethyl Acetate

C4H8O2

HCID24682

Sulfur trioxide

O3S

HCID81531

Diisopropylethylamine

C8H19N

HCID178459512

未命名化合物

PRODUCTS

产物

HCID178459511

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-9853911565b74da9905b7bdd4b2bf2b4
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

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