HRID138018

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID16523

Methyl 2,4-dihydroxybenzoate

C8H8O4

HCID19660

Carbonate

CO3-2

HCID4073409

1-Chloro-3,7,11-trimethyl-2,6,10-dodecatriene

C15H25Cl

PRODUCTS

生成物

结构：COC(=O)c1ccc(OCC=C(C)CCC=C(C)CCC=C(C)C)cc1O

HCID53714397

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b6a4d6b5c32a4b9fa1064a4523d4dea6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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