HRID92509

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID76082

6-Amino-m-cresol

C7H9NO

HCID76809

N-((1,1-Dimethylethoxy)carbonyl)-beta-alanine

C8H15NO4

PRODUCTS

生成物

结构：Cc1ccc(NC(=O)CCNC(=O)OC(C)(C)C)c(O)c1

HCID19010153

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c633488db6604fe992113d43f5a117e3
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]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][C:11](=[O:12])[OH:13].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[CH:14]1([N:15]=[C:16]=[N:17][CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]2)[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]1.[NH2:29][c:30]1[cH:31][cH:32][c:33]([CH3:37])[cH:34][c:35]1[OH:36]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][C:11](=[O:13])[NH:29][c:30]1[cH:31][cH:32][c:33]([CH3:37])[cH:34][c:35]1[OH:36]