Sulbactam sodium - ≥98% , Bacterial beta-lactamase TEM inhibitor, CAS No.69388-84-7, Bacterial beta-lactamase TEM inhibitor

CAS: 69388-84-7 Cat. No.: E129334 Molecular Weight: 255.22 EC Number: 273-984-4

GRADE & PURITY ≥98%

Synonyms

NKZMPZCWBSWAOX-IBTYICNHSA-M | SODIUM (2S-CIS)-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-2-CARBOXYLATE 4,4-DIOXIDE | Sulbactam Sodium, Antibiotic for Culture Media Use Only | DKQ4T82YE6 | SULBACTAM SODIUM [MART.] | Sodium 1,1-dioxopenicillanate

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

Sulbactam sodium (Unasyn) is an irreversible β-lactamase inhibitor.
A β-lactamase inhibitor that has similar characteristics as ampicillin.

Specifications

Synonyms

NKZMPZCWBSWAOX-IBTYICNHSA-M | SODIUM (2S-CIS)-3, 3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-2-CARBOXYLATE 4, 4-DIOXIDE | Sulbactam Sodium, Antibiotic for Culture Media Use Only | DKQ4T82YE6 | SULBACTAM SODIUM [MART.] | Sodium 1, 1-dioxopenicillanate

Specifications & Purity

≥98%

Biochemical and Physiological Mechanisms

Sulbactam sodium salt is a β-lactamase inhibitor that has similar characteristics as ampicillin.Irreversible β-lactamase inhibitor (IC 50 = 0.02 - 1.9 μM). Increases the activity of β-lactam antibiotics. Active in vitro and in vivo .

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Action Type

INHIBITOR

Mechanism of action

Bacterial beta-lactamase TEM inhibitor

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: CC1(C(N2C(S1(=O)=O)CC2=O)C(=O)[O-])C.[Na+]
• IUPAC Name: sodium;(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
• InChIKey: NKZMPZCWBSWAOX-IBTYICNHSA-M
• INCHI: 1S/C8H11NO5S.Na/c1-8(2)6(7(11)12)9-4(10)3-5(9)15(8,13)14;/h5-6H,3H2,1-2H3,(H,11,12);/q;+1/p-1/t5-,6+;/m1./s1
• Isomeric SMILES: CC1([C@@H](N2[C@H](S1(=O)=O)CC2=O)C(=O)[O-])C.[Na+]
• Molecular Weight: 255.22
• Reaxy-Rn: 1137390
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1137390&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Alpha amino acids and derivatives
• Alternative Parents: Penams Thiazolidines Tertiary carboxylic acid amides Sulfones Carboxylic acid salts Azetidines Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Alpha-amino acid or derivatives - Penam - Beta-lactam - Sulfone - Tertiary carboxylic acid amide - Thiazolidine - Azetidine - Carboxamide group - Carboxylic acid salt - Lactam - Organic alkali metal salt - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic salt - Organic sodium salt - Organic cation - Aliphatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Chemical and Physical Properties

• Solubility: DMSO 3 mg/mL Water 51 mg/mL Ethanol
• Sensitivity: Hygroscopic
• Molecular Weight: 255.230 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 255.018 Da
• Monoisotopic Mass: 255.018 Da
• Topological Polar Surface Area: 103.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 452.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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