CHEBI:77605 - tosufloxacin tosylate

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ChEBI Name tosufloxacin tosylate
ChEBI ID CHEBI:77605
Definition A racemate comprising equimolar amounts of (R)- and (S)-tosufloxacin tosylate.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H23F3N4O6S
Net Charge 0
Average Mass 576.54400
Monoisotopic Mass 576.12904
InChI InChI=1S/C19H15F3N4O3.C7H8O3S/c20-9-1-2-15(13(21)5-9)26-8-12(19(28)29)16(27)11-6-14(22)18(24-17(11)26)25-4-3-10(23)7-25;1-6-2-4-7(5-3-6)11(8,9)10/h1-2,5-6,8,10H,3-4,7,23H2,(H,28,29);2-5H,1H3,(H,8,9,10)
InChIKey CSSQVOKOWWIUCX-UHFFFAOYSA-N
SMILES Cc1ccc(cc1)S(O)(=O)=O.NC1CCN(C1)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)-c1ccc(F)cc1F
Roles Classification
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
DNA synthesis inhibitor
Any substance that inhibits the synthesis of DNA.
hepatotoxic agent
A role played by a chemical compound exihibiting itself through the ability to induce damage to the liver in animals.
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.
Application(s): antiinfective agent
A substance used in the prophylaxis or therapy of infectious diseases.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing tosufloxacin tosylate (CHEBI:77605) has part (R)-tosufloxacin tosylate (CHEBI:77607)
tosufloxacin tosylate (CHEBI:77605) has part (S)-tosufloxacin tosylate (CHEBI:77606)
tosufloxacin tosylate (CHEBI:77605) has part tosufloxacin(1+) (CHEBI:77586)
tosufloxacin tosylate (CHEBI:77605) has role antiinfective agent (CHEBI:35441)
tosufloxacin tosylate (CHEBI:77605) has role antimicrobial agent (CHEBI:33281)
tosufloxacin tosylate (CHEBI:77605) has role DNA synthesis inhibitor (CHEBI:59517)
tosufloxacin tosylate (CHEBI:77605) has role hepatotoxic agent (CHEBI:50908)
tosufloxacin tosylate (CHEBI:77605) has role topoisomerase IV inhibitor (CHEBI:53559)
tosufloxacin tosylate (CHEBI:77605) is a racemate (CHEBI:60911)
Incoming tosufloxacin tosylate hydrate (CHEBI:32248) has part tosufloxacin tosylate (CHEBI:77605)
IUPAC Names
rac-1-[6-carboxy-8-(2,4-difluorophenyl)-3-fluoro-5-oxo-5,8-dihydro-1,8-naphthyridin-2-yl]pyrrolidin-3-aminium 4-methylbenzenesulfonate
rac-7-(3-aminopyrrolidin-1-yl)-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid 4-methylbenzenesulfonate
Synonyms Sources
(±)-tosufloxacin tosylate ChEBI
(RS)-tosufloxacin tosylate ChEBI
A 61827 ChemIDplus
A-61827 ChemIDplus
rac-tosufloxacin tosylate ChEBI
racemic tosufloxacin tosylate ChEBI
tosufloxacin monotosylate ChEBI
Tosufloxacin tosilate ChEBI
Registry Numbers Types Sources
100490-94-6 CAS Registry Number ChemIDplus
115964-29-9 CAS Registry Number ChemIDplus
7617816 Reaxys Registry Number Reaxys
Last Modified
06 March 2014