HRID194855

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID13007

Piperidine, 1-ethyl-

C7H15N

HCID62493

2,2-Dimethylpropanoyl chloride

C5H9ClO

HCID75737

(+/-)-Phenylalanine methyl ester

C10H13NO2

HCID246565

Z-DL-asparagine

C12H14N2O5

PRODUCTS

生成物

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

HCID3456353

AC1MQRFJ

C22H25N3O6

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-629c049973314194a0650c03b5cb0121
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:28]([Cl:29])(=[O:30])[C:31]([CH3:32])([CH3:33])[CH3:34].[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]([NH2:15])=[O:16])[C:17](=[O:18])[OH:19].[CH3:20][CH2:21][N:22]1[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]1.[CH3:35][O:36][C:37]([CH:38]([NH2:39])[CH2:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)=[O:47].[Cl:49][CH2:50][Cl:51].[ClH:48].[cH:52]1[cH:53][cH:54][n:55][cH:56][cH:57]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]([CH2:13][C:14]([NH2:15])=[O:16])[C:17](=[O:19])[NH:39][CH:38]([C:37]([O:36][CH3:35])=[O:47])[CH2:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1