CHEBI:53749 - gemifloxacin mesylate

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ChEBI Name gemifloxacin mesylate
ChEBI ID CHEBI:53749
Definition The mesylate salt of gemifloxacin.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C19H24FN5O7S
Net Charge 0
Average Mass 485.48700
Monoisotopic Mass 485.13805
InChI InChI=1S/C18H20FN5O4.CH4O3S/c1-28-22-14-8-23(6-9(14)5-20)17-13(19)4-11-15(25)12(18(26)27)7-24(10-2-3-10)16(11)21-17;1-5(2,3)4/h4,7,9-10H,2-3,5-6,8,20H2,1H3,(H,26,27);1H3,(H,2,3,4)/b22-14+;
InChIKey JIYMVSQRGZEYAX-CWUUNJJBSA-N
SMILES CS(O)(=O)=O.CO\N=C1/CN(CC1CN)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1
Roles Classification
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
topoisomerase IV inhibitor
A topoisomerase inhibitor that inhibits DNA topoisomerase IV, which catalyses ATP-dependent breakage of both strands of DNA, passage of the unbroken strands through the breaks, and rejoining of the broken strands.
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ChEBI Ontology
Outgoing gemifloxacin mesylate (CHEBI:53749) has part gemifloxacin (CHEBI:101853)
gemifloxacin mesylate (CHEBI:53749) has role antimicrobial agent (CHEBI:33281)
gemifloxacin mesylate (CHEBI:53749) has role topoisomerase IV inhibitor (CHEBI:53559)
gemifloxacin mesylate (CHEBI:53749) is a methanesulfonate salt (CHEBI:38037)
IUPAC Name
7-[3-(aminomethyl)-4-(methoxyimino)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid methanesulfonate
Manual Xrefs Databases
D02471 KEGG DRUG
DB01155 DrugBank
View more database links
Registry Numbers Types Sources
210353-53-0 CAS Registry Number ChemIDplus
210353-53-0 CAS Registry Number KEGG DRUG
9176911 Beilstein Registry Number Beilstein
Last Modified
04 December 2009