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81103-11-9

81103-11-9 structural image
Product Name: Clarithromycin
Formula: C38H69NO13
Synonyms: 6-O-methyl erythromycin;CLM
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Color/Form Colorless needles from chloroform + diisopropyl ether (1:2) ... Also reported as crystals from ethanol
Melting Point 220 dec °C
Solubility 0.33 mg/L
LogP 3.16
Optical Rotation Specific optical rotation: -90.4 deg at 24 °C/D (c = 1 in CHCl3)
Decomposition When heated to decomposition it emits toxic vapors of /oxides of nitrogen/.
Ionization Efficiency Positive
Dissociation Constants 8.99
Collision Cross Section 264.2 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]
Other Experimental Properties Stable at acidic pH

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 748.0 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 8
Exact Mass 747.47689126 g/mol
Monoisotopic Mass 747.47689126 g/mol
Topological Polar Surface Area 183 Ų
Heavy Atom Count 52
Formal Charge 0
Complexity 1190
Isotope Atom Count 0
Defined Atom Stereocenter Count 18
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

Description

Clarithromycin is the 6-O-methyl ether of erythromycin A. clarithromycin is a macrolide antibiotic used to treat respiratory tract, skin and soft-tissue infections. It is also used to eradicate Helicobacter pylori in treating peptic ulcer disease. It prevents bacteria from growing by interfering with their protein synthesis. Clarithromycin has a role as an antibacterial drug, a protein synthesis inhibitor, an environmental contaminant and a xenobiotic.

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