HRID149543

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID7345

N-Acetylalanine

C5H9NO3

HCID7972

4-Methylmorpholine

C5H11NO

HCID8028

Tetrahydrofuran

C4H8O

HCID62365

Isobutyl chloroformate

C5H9ClO2

HCID21392392

未命名化合物

PRODUCTS

生成物

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

HCID21392378

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e625d23f5cd44ad89f496437919a3bf5
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:1]([CH3:2])(=[O:3])[NH:4][CH:5]([CH3:6])[C:7](=[O:8])[OH:9].[CH2:26]([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[O:33][C:34]([CH:35]([NH:36][C:37]([CH:38]([NH2:39])[CH3:40])=[O:41])[CH2:42][CH:43]([CH3:44])[CH3:45])=[O:46].[CH3:10][N:11]1[CH2:12][CH2:13][O:14][CH2:15][CH2:16]1.[Cl:17][C:18]([O:19][CH2:20][CH:21]([CH3:22])[CH3:23])=[O:24].[ClH:25].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1>>[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]([CH3:6])[C:7](=[O:8])[NH:39][CH:38]([C:37]([NH:36][CH:35]([C:34]([O:33][CH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)=[O:46])[CH2:42][CH:43]([CH3:44])[CH3:45])=[O:41])[CH3:40]