Desmethyl Levofloxacin - ≥98% , CAS No.117707-40-1

CAS: 117707-40-1 Cat. No.: D330778 Molecular Weight: 347.34 EC Number: 808-725-1 PubChem CID: 10958963

GRADE & PURITY ≥98%

Synonyms

N-Desmethyl levofloxacin | Desmethyl levofloxacin | Levofloxacin Related Compound A | (S)-9-Fluoro-2,3-dihydro-3-methyl-10-(piperazin-1-yl)-7-oxo-7H-pyrido(1,2,3-de)(1,4)benzoxazine-6-carboxyl

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Product Describtion:

Desmethyl Levofloxacin is a metabolite of Levofloxacin. Levofloxacin, a synthetic fluoroquinolone, is an antibacterial agent that inhibits the supercoiling activity of bacterial DNA gyrase, halting DNA replication.

Specifications

Synonyms

N-Desmethyl levofloxacin | Desmethyl levofloxacin | Levofloxacin Related Compound A | (S)-9-Fluoro-2, 3-dihydro-3-methyl-10-(piperazin-1-yl)-7-oxo-7H-pyrido(1, 2, 3-de)(1, 4)benzoxazine-6-carboxyl

Specifications & Purity

≥98%

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.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: C[C@H]1COc2c(N3CCNCC3)c(F)cc4C(=O)C(=CN1c24)C(O)=O
• IUPAC Name: (2S)-7-fluoro-2-methyl-10-oxo-6-piperazin-1-yl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid
• InChIKey: WKRSSAPQZDHYRV-VIFPVBQESA-N
• INCHI: 1S/C17H18FN3O4/c1-9-8-25-16-13-10(15(22)11(17(23)24)7-21(9)13)6-12(18)14(16)20-4-2-19-3-5-20/h6-7,9,19H,2-5,8H2,1H3,(H,23,24)/t9-/m0/s1
• Isomeric SMILES: C[C@H]1COC2=C3N1C=C(C(=O)C3=CC(=C2N4CCNCC4)F)C(=O)O
• PubChem CID: 10958963
• Molecular Weight: 347.34

Associated Targets(non-human)

Pseudomonas aeruginosa (123386 Activities)

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Klebsiella pneumoniae (43867 Activities)

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Shigella flexneri (1836 Activities)

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Staphylococcus aureus (210822 Activities)

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Staphylococcus epidermidis (22802 Activities)

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Escherichia coli (133304 Activities)

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Salmonella typhi (4293 Activities)

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Serratia marcescens (3237 Activities)

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Bacillus subtilis (32866 Activities)

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Mechanisms of Action

Chemical and Physical Properties

• Melt Point(°C): >220° C (dec.)
• Molecular Weight: 347.340 g/mol
• XLogP3: -0.900
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 347.128 Da
• Monoisotopic Mass: 347.128 Da
• Topological Polar Surface Area: 82.100 Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 607.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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: 1