Amoxicillin Sodium - ≥89% , CAS No.34642-77-8

CAS: 34642-77-8 Cat. No.: A137746 分子式: C₁₆H₁₈N₃O₅S.Na 分子量: 387.39 EC番号: 252-124-1

GRADE & PURITY ≥89%

Synonyms

Quimiopen | BYHDFCISJXIVBV-YWUHCJSESA-M | (2S-(2alpha,5alpha,6beta(S*)))-6-((Amino(4-hydroxyphenyl)acetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid monosodium salt | CHEBI:51255 | sodium (2S,5R,6R)-6-((R)-2-amino-2-(4-h

Storage

Room temperature

Shipped In

Normal

概要

Amoxicillin Sodium is a moderate- spectrum, bacteriolytic, β-lactam antibiotic.

Specifications

同義語

Quimiopen | BYHDFCISJXIVBV-YWUHCJSESA-M | (2S-(2alpha,5alpha,6beta(S*)))-6-((Amino(4-hydroxyphenyl)acetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid monosodium salt | CHEBI:51255 | sodium (2S,5R,6R)-6-((R)-2-amino-2-(4-h

仕様と純度

≥89%

生化学的・生理学的メカニズム

Amoxicillin sodium (Amox) is a moderate- spectrum, bacteriolytic, β-lactam antibiotic. Amoxicillin sodium (Amox) is used to treat bacterial infections caused by susceptible microorganisms. Amoxicillin sodium (Amox) is usually the drug of choice within the

保管条件

Room temperature

入荷

Normal

アクションタイプ

INHIBITOR

純度

≥89%

名前と識別子

• パブケム・シド: 488200379
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/488200379
• カノニカル・スマイル: CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)C(=O)[O-])C.[Na+]
• IUPAC Name: sodium;(2S,5R,6R)-6-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
• InChIKey: BYHDFCISJXIVBV-YWUHCJSESA-M
• INCHI: 1S/C16H19N3O5S.Na/c1-16(2)11(15(23)24)19-13(22)10(14(19)25-16)18-12(21)9(17)7-3-5-8(20)6-4-7;/h3-6,9-11,14,20H,17H2,1-2H3,(H,18,21)(H,23,24);/q;+1/p-1/t9-,10-,11+,14-;/m1./s1
• 異性体SMILES: CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)N)C(=O)[O-])C.[Na+]
• 分子量: 387.39
• Reaxy-Rn: 1184044
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1184044&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 分類 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
• 分類: 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: Penams Aralkylamines Phenoxides Thiazolidines Tertiary carboxylic acid amides Amino acids Azetidines Thiohemiaminal derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidic acids Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Organopnictogen compounds Hydrocarbon derivatives Monoalkylamines Carbonyl compounds Organic oxides Organic sodium salts Organic zwitterions
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: N-acyl-alpha amino acid or derivatives - Penam - Phenoxide - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Beta-lactam - Tertiary carboxylic acid amide - Thiazolidine - Carboxamide group - Lactam - Azetidine - Amino acid - Azacycle - Organic alkali metal salt - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Thioether - Hemithioaminal - Dialkylthioether - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organic oxygen compound - Organic sodium salt - Organooxygen compound - Organopnictogen compound - Organic oxide - Primary amine - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - Amine - Carbonyl group - Primary aliphatic amine - Aromatic heteropolycyclic compound
• 説明: 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 sodium salt

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

作用メカニズム

化学的性質と物理的性質

• 溶解度: DMSO 78 mg/mL Water 78 mg/mL Ethanol
• 感度: Hygroscopic
• 分子量: 387.400 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 387.086 Da
• Monoisotopic Mass: 387.086 Da
• Topological Polar Surface Area: 161.000 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 596.000
• 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