Flomoxef , CAS No.99665-00-6

CAS: 99665-00-6 Cat. No.: F1419328 Molecular Weight: 496.47 PubChem CID: 65864

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Flomoxef is a oxacephem group antibiotic , with excellent activity against various Gram-positive bacteria.

Specifications

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

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

Product Properties

• ALogP: -1.3

Names and Identifiers

• Canonical Smiles: COC1(C2N(C1=O)C(=C(CO2)CSC3=NN=NN3CCO)C(=O)O)NC(=O)CSC(F)F
• IUPAC Name: (6R,7R)-7-[[2-(difluoromethylsulfanyl)acetyl]amino]-3-[[1-(2-hydroxyethyl)tetrazol-5-yl]sulfanylmethyl]-7-methoxy-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
• InChIKey: UHRBTBZOWWGKMK-DOMZBBRYSA-N
• INCHI: 1S/C15H18F2N6O7S2/c1-29-15(18-8(25)6-31-13(16)17)11(28)23-9(10(26)27)7(4-30-12(15)23)5-32-14-19-20-21-22(14)2-3-24/h12-13,24H,2-6H2,1H3,(H,18,25)(H,26,27)/t12-,15+/m1/s1
• Isomeric SMILES: CO[C@@]1([C@@H]2N(C1=O)C(=C(CO2)CSC3=NN=NN3CCO)C(=O)O)NC(=O)CSC(F)F
• PubChem CID: 65864
• Molecular Weight: 496.47

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: Oxacephems Alkylarylthioethers Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Azetidines Alkanolamines Sulfenyl compounds Azacyclic compounds Carboxylic acids Dialkylthioethers Oxacyclic compounds Monocarboxylic acids and derivatives Primary alcohols Carbonyl compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organofluorides Organopnictogen compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: N-acyl-alpha amino acid or derivatives - Oxacephem - Aryl thioether - Alkylarylthioether - Azole - Beta-lactam - Tertiary carboxylic acid amide - Heteroaromatic compound - Tetrazole - Azetidine - Carboxamide group - Lactam - Secondary carboxylic acid amide - Thioether - Oxacycle - Organoheterocyclic compound - Azacycle - Dialkylthioether - Sulfenyl compound - Alkanolamine - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Organopnictogen compound - Organonitrogen compound - Alkyl fluoride - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alcohol - Organic oxide - Primary alcohol - Alkyl halide - 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: 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