HRID1152915

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID3144

4,7,10,13,16,19-Docosahexaenoic acid

C22H32O2

HCID6342

Acetonitrile

C2H3N

HCID8857

Ethyl acetate

C4H8O2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID81531

Diisopropylethylamine

C8H19N

HCID111314

DL-Alanine methyl ester

C4H9NO2

PRODUCTS

生成物

结构：CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)NC(C)C(=O)OC

HCID85041004

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-be4327892dcc4c30856a76a3eada16ec
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:9]([CH2:10][CH2:11][CH:12]=[CH:13][CH2:14][CH:15]=[CH:16][CH2:17][CH:18]=[CH:19][CH2:20][CH:21]=[CH:22][CH2:23][CH:24]=[CH:25][CH2:26][CH:27]=[CH:28][CH2:29][CH3:30])(=[O:31])[OH:32].[CH3:2][O:3][C:4]([CH:5]([NH2:6])[CH3:7])=[O:8].[CH3:33][CH2:34][N:35]=[C:36]=[N:37][CH2:38][CH2:39][CH2:40][N:41]([CH3:42])[CH3:43].[CH3:53][C:54]#[N:55].[CH3:56][CH2:57][O:58][C:59]([CH3:60])=[O:61].[CH:44]([N:45]([CH2:46][CH3:47])[CH:48]([CH3:49])[CH3:50])([CH3:51])[CH3:52].[ClH:1]>>[CH3:2][O:3][C:4]([CH:5]([NH:6][C:9]([CH2:10][CH2:11][CH:12]=[CH:13][CH2:14][CH:15]=[CH:16][CH2:17][CH:18]=[CH:19][CH2:20][CH:21]=[CH:22][CH2:23][CH:24]=[CH:25][CH2:26][CH:27]=[CH:28][CH2:29][CH3:30])=[O:31])[CH3:7])=[O:8]