HRID668926

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID67749

Trifluoromethanesulfonic anhydride

C2F6O5S2

结构：COC(=O)C(Cc1ccc(O)cc1)NC(=O)OC(C)(C)C

HCID4459028

Methyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosinate

C15H21NO5

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccc(OS(=O)(=O)C(F)(F)F)cc1)NC(=O)OC(C)(C)C

HCID14560583

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-017951dcfb8e4ff6963d476d00820bfe
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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