HRID2318623

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID13172082

未命名化合物

结构：CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)c1ccncc1-2

HCID19781402

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：CCCCCC(C)C(C)c1cc(OC(=O)CCCCN2CCCCC2)c2c(c1)OC(C)(C)c1ccncc1-2

HCID20287864

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c49d57d5cfd84634b5a90d7ff6d7dfd8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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