HRID166623

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID75737

(+/-)-Phenylalanine methyl ester

C10H13NO2

HCID107296

benzyl N-(2,5-dioxooxolan-3-yl)carbamate

C12H11NO5

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccccc1)NC(=O)C(CC(=O)O)NC(=O)OCc1ccccc1

HCID118092

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-33453667f27c41828e684205ca31afb5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:33](=[O:34])([O-:35])[O-:36].[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]1[CH2:13][C:14](=[O:15])[O:16][C:17]1=[O:18].[CH3:20][O:21][C:22]([CH:23]([NH2:24])[CH2:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)=[O:32].[CH3:39][C:40](=[O:41])[OH:42].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[ClH:19].[K+:37].[K+:38].[OH2:49]>>[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]([CH2:13][C:14](=[O:15])[OH:16])[C:17](=[O:18])[NH:24][CH:23]([C:22]([O:21][CH3:20])=[O:32])[CH2:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1