HRID101113

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID280

Carbon dioxide

CO2

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID14349

Glycine, N-[(phenylmethoxy)carbonyl]-

C10H11NO4

HCID75737

(+/-)-Phenylalanine methyl ester

C10H13NO2

HCID5250894

未命名化合物

PRODUCTS

生成物

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

HCID297863

Methyl N-[(benzyloxy)carbonyl]glycylphenylalaninate

C20H22N2O5

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-66543032a1ab499e943fc13f7ade4b64
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:1]([c:2]1[nH:3][cH:4][cH:5][n:6]1)([c:7]1[nH:8][cH:9][cH:10][n:11]1)=[O:12].[C:28](=[O:29])=[O:30].[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[O:20][C:21](=[O:22])[NH:23][CH2:24][C:25](=[O:26])[OH:27].[CH3:31][O:32][C:33]([CH:34]([NH2:35])[CH2:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)=[O:43].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH2:44]>>[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[O:20][C:21](=[O:22])[NH:23][CH2:24][C:25](=[O:27])[NH:35][CH:34]([C:33]([O:32][CH3:31])=[O:43])[CH2:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1