Faropenem Sodium - 10mM in DMSO , CAS No.122547-49-3

CAS: 122547-49-3 Cat. No.: F420969 Fórmula: C₁₂H₁₄NNaO₅S Peso molecular: 307.3

GRAU & PUREZA 10mM in DMSO

Synonyms

BLA-857 | sodium (5R,6S)-6-((R)-1-hydroxyethyl)-7-oxo-3-((R)-tetrahydrofuran-2-yl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate | CCG-267545 | Farom | Faropenem Sodium Salt Hemipentahydrate | SUN-5555 | YM-044 | FLUORESCEIN SODIUM [JAN] | SCHEMBL477

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Visão geral

Information

Faropenem sodium is an orally active beta-lactam antibiotic that has been used in trials studying the treatment of Tuberculosis, Pulmonary Tuberculosis, and Community Acquired Pneumonia.

Especificações

Sinónimos

BLA-857 | sodium (5R,6S)-6-((R)-1-hydroxyethyl)-7-oxo-3-((R)-tetrahydrofuran-2-yl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate | CCG-267545 | Farom | Faropenem Sodium Salt Hemipentahydrate | SUN-5555 | YM-044 | FLUORESCEIN SODIUM [JAN] | SCHEMBL477

Especificações e pureza

10mM in DMSO

Mecanismos bioquímicos e fisiológicos

Faropenem sodium is an orally active beta-lactam antibiotic that has been used in trials studying the treatment of Tuberculosis, Pulmonary Tuberculosis, and Community Acquired Pneumonia.

Condições de armazenamento de armazenamento

Store at -80°C

Enviado em

Dry ice packs + Cold packs

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Tipo de ação

INHIBITOR

Propriedades do produto

ALogP

-1.793

hba_count

2

Contagem HBD

1

Ligação rotativa

3

Nomes e identificadores

Pubchem Sid

528764498

Sorrisos canónicos

CC(C1C2N(C1=O)C(=C(S2)C3CCCO3)C(=O)[O-])O.[Na+]

IUPAC Name

sodium;(5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(2R)-oxolan-2-yl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

InChIKey

ICSAXRANXQSPQP-VUKDEKJYSA-M

INCHI

1S/C12H15NO5S.Na/c1-5(14)7-10(15)13-8(12(16)17)9(19-11(7)13)6-3-2-4-18-6;/h5-7,11,14H,2-4H2,1H3,(H,16,17);/q;+1/p-1/t5-,6-,7+,11-;/m1./s1

SMILES isoméricas

C[C@H]([C@@H]1[C@@H]2N(C1=O)C(=C(S2)[C@H]3CCCO3)C(=O)[O-])O.[Na+]

CAS alternativo

106560-14-9

Peso molecular

307.3

Reaxy-Rn

52773848

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=52773848&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe 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
• Classe: 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: Thiazolecarboxylic acids and derivatives Penems Vinylogous thioesters Thiazolines Tertiary carboxylic acid amides Oxolanes Azetidines Thioenol ethers Secondary alcohols Carboxylic acid salts Azacyclic compounds Thiohemiaminal derivatives Oxacyclic compounds Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic sodium salts Organic zwitterions Organonitrogen compounds
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Alpha-amino acid or derivatives - Penem - Thiazolecarboxylic acid or derivatives - Vinylogous thioester - Beta-lactam - Oxolane - Tertiary carboxylic acid amide - Thiazole - Meta-thiazoline - Azetidine - Carboxamide group - Carboxylic acid salt - Lactam - Secondary alcohol - Thioenolether - Oxacycle - Carboxylic acid - Dialkyl ether - Ether - Azacycle - Monocarboxylic acid or derivatives - Organic alkali metal salt - Organoheterocyclic compound - Hemithioaminal - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic sodium salt - Alcohol - Organic salt - Organic zwitterion - Aliphatic heteropolycyclic compound
• Descrição: 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

Alvos associados (não humanos)

Pseudomonas aeruginosa (123386 Activities)

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Enterobacter cloacae (7976 Activities)

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Klebsiella pneumoniae (43867 Activities)

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Proteus vulgaris (5823 Activities)

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Staphylococcus aureus (210822 Activities)

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Citrobacter freundii (1864 Activities)

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Escherichia coli (133304 Activities)

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Serratia marcescens (3237 Activities)

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Bacillus subtilis (32866 Activities)

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Mecanismos de ação

Propriedades químicas e físicas

• DMSO (mg/mL) Solubilidade máxima: 12
• DMSO (mM) Solubilidade máxima: 39.04978848
• Água (mg/mL) Solubilidade máxima: 61
• Água (mM) Solubilidade máxima: 198.5030914
• Peso molecular: 307.300 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 307.049 Da
• Monoisotopic Mass: 307.049 Da
• Topological Polar Surface Area: 115.000 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 482.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• 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

XLogP3