Cefuroxime sodium salt - 10mM in DMSO , Bacterial penicillin-binding protein inhibitor, CAS No.56238-63-2, Bacterial penicillin-binding protein inhibitor

CAS: 56238-63-2 Cat. No.: C424763 Molecular Weight: 446.37 EC Number: 260-073-1

GRADE & PURITY 10mM in DMSO

Synonyms

CEFUROXIME SODIUM|Sodium cefuroxime|Anaptivan|Biociclin|Cefuroxime sodium salt|Zinacef|56238-63-2|Colifossim|Spectrazolr|Bioxima|Cefofix|Cefumax|Cefurex|Curoxim|Curoxima|Curoxime|Furoxil|Lifurox|Medoxim|Ultroxim|Kesint|Cefuroxim Hexal|Cefuroxim Lilly|Cefu

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifications

Synonyms

CEFUROXIME SODIUM | Sodium cefuroxime | Anaptivan | Biociclin | Cefuroxime sodium salt | Zinacef | 56238-63-2 | Colifossim | Spectrazolr | Bioxima | Cefofix | Cefumax | Cefurex | Curoxim | Curoxima | Curoxime | Furoxil | Lifurox | Medoxim | Ultroxim | Kesint | Cefuroxim Hexal | Cefuroxim Lilly | Cefu

Specifications & Purity

10mM in DMSO

Biochemical and Physiological Mechanisms

Broad-spectrum cephalosporin antibiotic. Antibacterial agent. Active in vivo and in vitro .

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

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

Action Type

INHIBITOR

Mechanism of action

Bacterial penicillin-binding protein inhibitor

Names and Identifiers

• Canonical Smiles: CON=C(C1=CC=CO1)C(=O)NC2C3N(C2=O)C(=C(CS3)COC(=O)N)C(=O)[O-].[Na+]
• IUPAC Name: sodium;(6R,7R)-3-(carbamoyloxymethyl)-7-[[(2Z)-2-(furan-2-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
• InChIKey: URDOHUPGIOGTKV-JTBFTWTJSA-M
• INCHI: 1S/C16H16N4O8S.Na/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20;/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24);/q;+1/p-1/b19-9-;/t10-,14-;/m1./s1
• Isomeric SMILES: CO/N=C(/C1=CC=CO1)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)COC(=O)N)C(=O)[O-].[Na+]
• WGK Germany: 2
• Molecular Weight: 446.37
• Reaxy-Rn: 14746872
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14746872&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
            • Level7 N-acyl-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 - Alpha amino acids and derivatives
• Direct Parent: N-acyl-alpha amino acids and derivatives
• Alternative Parents: Cephems 1,3-thiazines Tertiary carboxylic acid amides Heteroaromatic compounds Furans Azetidines Thiohemiaminal derivatives Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Carboximidic acids Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Hydrocarbon derivatives Imines Organic oxides Carbonyl compounds Organic sodium salts Organic zwitterions Organopnictogen compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: N-acyl-alpha amino acid or derivatives - Cephem - Meta-thiazine - Beta-lactam - Heteroaromatic compound - Furan - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Lactam - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organic alkali metal salt - Thioether - Hemithioaminal - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Dialkylthioether - Organoheterocyclic compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic sodium salt - Organic oxide - Organic oxygen compound - Organic zwitterion - Hydrocarbon derivative - Organopnictogen compound - Imine - Organic salt - Carbonyl group - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
• External Descriptors: organic molecular entity

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

Associated Targets(Human)

POLB Tchem DNA polymerase beta (23632 Activities)

Discover Target: POLB

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HSD17B10 Tchem Endoplasmic reticulum-associated amyloid beta-peptide-binding protein (20669 Activities)

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POLK Tbio DNA polymerase kappa (8653 Activities)

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POLI Tchem DNA polymerase iota (116820 Activities)

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POLH Tchem DNA polymerase eta (21678 Activities)

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KDM4A Tchem Lysine-specific demethylase 4A (52245 Activities)

Discover Target: KDM4A

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EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)

Discover Target: EHMT2

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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

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ERG Tbio Transcriptional regulator ERG (5589 Activities)

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SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)

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SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 Activities)

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CTDSP1 Tchem Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 (1031 Activities)

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GLS Tchem Glutaminase kidney isoform, mitochondrial (16997 Activities)

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KPNB1 Tbio Importin subunit beta-1/Snurportin-1 (25097 Activities)

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Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)

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Pkm Pyruvate kinase isozymes M1/M2 (66 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

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Txnrd1 Thioredoxin reductase 1, cytoplasmic (45279 Activities)

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TGR Thioredoxin glutathione reductase (28579 Activities)

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Mapt Microtubule-associated protein tau (6 Activities)

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Mechanisms of Action

Chemical and Physical Properties

• Molecular Weight: 446.400 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 8
• Exact Mass: 446.051 Da
• Monoisotopic Mass: 446.051 Da
• Topological Polar Surface Area: 202.000 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 804.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 2

XLogP3

References

1. Hao-Jia Qin, Shuai Zhao, Hua-Ping Gong, Zhi Yu, Yufeng Wang, De Zhang, Pei Liang.  (2024)  Synthesis and characterization of Au@Ag/Ce-UIO-66 nanocomposite for highly sensitive detection of sulfadiazine residue.  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2024.110415]

2. Feiyu Yu, Shuyao Zhu, Qingyang Lv, Dan Fang, Haijie Zhang, Zhiqiang Wang, Yuan Liu.  (2025)  Lon dysfunction-mediated collateral sensitivity drives effective antibiotic combination therapies against tigecycline-resistant pathogens.  Cell Reports,      [PMID:40650911] [10.1016/j.celrep.2025.115987]

3. Jiansheng Lin, Chunyan Lin, Jingyang Zheng.  (2025)  LysR-type transcriptional regulator CARR represses the expression of blaCAR-2 and reduces P. diazotrophicus resistance to cefalothin, cefuroxime and cefotaxime.  Frontiers in Cellular and Infection Microbiology,      [PMID:40959139] [10.3389/fcimb.2025.1616646]

4. Chao Wang, Peijuan Chu, Tengfei He, Cheng Yi, Yue Yao, Lijia Liu, Chunhong Zhang.  (2025)  Natural product flavonoid of naringenin based thin-film composite polyester membranes preparation for antibiotic separation.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2025.134123]

5. Jiaxuan Liu, Wensi Ma, Xinyue Huang, Lei Jiang, Lin Yuan, Xiuling Ji, Yujiao Tu.  (2025)  Rapeseed oil residue-based fluorescent probes for bifunctional detection of Hg2+ and aureomycin hydrochloride.  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2025.114165]