HRID1560937

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID887

Methanol

CH4O

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID7412

Benzoyl chloride

C7H5ClO

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl Acetate

C4H8O2

HCID22141444

未命名化合物

PRODUCTS

产物

HCID22141446

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-9de007a37ec1406ebe1cf4f202643484
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应SMILES

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