HRID298295

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID887

Methanol

CH4O

HCID6212

Chloroform

CHCl3

HCID75737

(+/-)-Phenylalanine methyl ester

C10H13NO2

HCID145424

3,5-Difluorophenylacetic acid

C8H6F2O2

HCID268471

未命名化合物

HCID13751943

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccccc1)NC(=O)C(C)NC(=O)Cc1cc(F)cc(F)c1

HCID22492060

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-de388cce80ba47e1a31aad73e987a8b8
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

[C:32]([NH:33][CH:34]([C:35]([OH:36])=[O:37])[CH3:38])([O:39][C:40]([CH3:41])([CH3:42])[CH3:43])=[O:44].[CH3:14][O:15][C:16]([CH:17]([NH:18][C:19]([CH:20]([NH2:21])[CH3:22])=[O:23])[CH2:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)=[O:31].[CH3:46][O:47][C:48](=[O:49])[CH:50]([CH2:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1)[NH2:58].[CH3:59][OH:60].[Cl:61][CH:62]([Cl:63])[Cl:64].[ClH:13].[ClH:45].[F:1][c:2]1[cH:3][c:4]([CH2:9][C:10](=[O:11])[OH:12])[cH:5][c:6]([F:8])[cH:7]1>>[F:1][c:2]1[cH:3][c:4]([CH2:9][C:10](=[O:12])[NH:21][CH:20]([C:19]([NH:18][CH:17]([C:16]([O:15][CH3:14])=[O:31])[CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)=[O:23])[CH3:22])[cH:5][c:6]([F:8])[cH:7]1