CAS 61270-71-1

(6R,7R)-7-Amino-8-oxo-3-[[[1-(sulfomethyl)-1H-tetrazol-5-yl]thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Description:

The chemical substance known as (6R,7R)-7-Amino-8-oxo-3-[[[1-(sulfomethyl)-1H-tetrazol-5-yl]thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, with the CAS number 61270-71-1, is a complex bicyclic compound that features a thiazolidine ring and a tetrazole moiety. This compound is characterized by its unique structural features, including an amino group and a carboxylic acid functional group, which contribute to its potential biological activity. The presence of the sulfomethyl group enhances its solubility and reactivity, making it of interest in medicinal chemistry, particularly in the development of antimicrobial agents. The stereochemistry indicated by the (6R,7R) configuration suggests specific spatial arrangements that may influence the compound's interaction with biological targets. Overall, this substance is notable for its potential applications in pharmaceuticals, particularly in the context of antibiotic development, due to its structural complexity and functional groups that may interact with various biological systems.

Formula: C₁₀H₁₂N₆O₆S₃

InChI: InChI=1S/C10H12N6O6S3/c11-5-7(17)16-6(9(18)19)4(1-23-8(5)16)2-24-10-12-13-14-15(10)3-25(20,21)22/h5,8H,1-3,11H2,(H,18,19)(H,20,21,22)/t5-,8-/m1/s1

InChI key: InChIKey=ATMROFNURATUIQ-SVGQVSJJSA-N

SMILES: C(O)(=O)C=1N2[C@@]([C@H](N)C2=O)(SCC1CSC=3N(CS(=O)(=O)O)N=NN3)[H]

Synonyms:

• (6R,7R)-7-Amino-8-oxo-3-[[[1-(sulfomethyl)-1H-tetrazol-5-yl]thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
• (6R,7R)-7-amino-8-oxo-3-({[1-(sulfomethyl)-1H-tetrazol-5-yl]sulfanyl}methyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
• 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-amino-8-oxo-3-[[[1-(sulfomethyl)-1H-tetrazol-5-yl]thio]methyl]-, (6R,7R)-
• 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-amino-8-oxo-3-[[[1-(sulfomethyl)-1H-tetrazol-5-yl]thio]methyl]-, (6R-trans)-
• (6R-trans)-7-Amino-8-oxo-3-(((1-(sulphomethyl)-1H-tetrazol-5-yl)thio)methyl)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid

Cefonicid Impurity 1

CAS: 61270-71-1

Formula: C₁₀H₁₂N₆O₆S₃

Molecular weight: 408.44

Ref: 4Z-C-189002