HRID703020

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID12380

Octane, 1-iodo-

C8H17I

HCID19660

Carbonate

CO3-2

HCID22247328

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCN1CC(CCO)c2c(C)cc(C)c(NC(=O)C(C)(C)C)c21

HCID15895568

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a04a61753ee74c8a9a5ff38ca760670b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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