HRID151973

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID162

6-Amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

C8H12N2O3S

HCID923

Sodium ion

Na+

HCID6212

Chloroform

CHCl3

HCID8857

Ethyl Acetate

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

HCID4072356

2-Ethylhexanoate

C8H15O2-

PRODUCTS

产物

HCID162

6-Amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

C8H12N2O3S

HCID3411517

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-56841b95b6ba4a19ac3c902636270845
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

[CH2:24]([CH:25]([CH2:26][CH2:27][CH2:28][CH3:29])[C:30]([O-:31])=[O:32])[CH3:33].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[CH:15]([CH3:16])([CH3:17])[N:18]([CH2:19][CH3:20])[CH:21]([CH3:22])[CH3:23].[CH:1]12[S:2][C:3]([CH3:4])([CH3:5])[CH:6]([C:12]([OH:13])=[O:14])[N:7]1[C:8](=[O:9])[CH:10]2[NH2:11].[CH:35]([Cl:36])([Cl:37])[Cl:38].[Na+:34]>>[CH:15]([CH3:16])([CH3:17])[NH+:18]([CH2:19][CH3:20])[CH:21]([CH3:22])[CH3:23].[CH:1]12[S:2][C:3]([CH3:4])([CH3:5])[CH:6]([C:12](=[O:13])[OH:14])[N:7]1[C:8](=[O:9])[CH:10]2[NH2:11]