HRID1239048

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

结构：CC(C)C(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

HCID100115

未命名化合物

HCID54529065

未命名化合物

PRODUCTS

生成物

结构：CC(C)C(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OCC(O)C=CC(=O)OCc1ccccc1

HCID178449680

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a3dfafaeab174af4b99e0f206ec75447
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:17](=[O:18])([O:19][CH2:20][CH:21]1[c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]2-[c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]21)[NH:34][CH:35]([CH:36]([CH3:37])[CH3:38])[C:39](=[O:40])[OH:41].[CH3:57][N:58]([c:59]1[cH:60][cH:61][n:62][cH:63][cH:64]1)[CH3:65].[CH:42]1([N:43]=[C:44]=[N:45][CH:46]2[CH2:47][CH2:48][CH2:49][CH2:50][CH2:51]2)[CH2:52][CH2:53][CH2:54][CH2:55][CH2:56]1.[Cl:66][CH2:67][Cl:68].[OH:1][CH:2]([CH:3]=[CH:4][C:5](=[O:6])[O:7][CH2:8][c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[CH2:15][OH:16]>>[OH:1][CH:2]([CH:3]=[CH:4][C:5](=[O:6])[O:7][CH2:8][c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[CH2:15][O:16][C:39]([CH:35]([NH:34][C:17](=[O:18])[O:19][CH2:20][CH:21]1[c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]2-[c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]21)[CH:36]([CH3:37])[CH3:38])=[O:40]