HRID2153220

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID947

Nitrogen

HCID61668

Boronic acid

H3BO2

2 次

结构：CC(C)(C)OC(=O)N1CCC(=Cc2cccc(B3OC(C)(C)C(C)(C)O3)c2)CC1

HCID57819376

未命名化合物

HCID178514824

未命名化合物

PRODUCTS

生成物

HCID57813446

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-89a723b6a4334bfda4adc1200fb305be
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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