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tosufloxacin tosylate hydrate - Ontology Report - Rat Genome Database

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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:tosufloxacin tosylate hydrate
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Accession:CHEBI:32248 term browser browse the term
Definition:A racemate comprising equimolar amounts of (R)- and (S)-tosufloxacin tosylate hydrate.
Synonyms:exact_synonym: 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--water (1/1);   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--water (1/1)
 related_synonym: (RS)-tosufloxacin tosylate hydrate;   Formula=C26H25F3N4O7S;   InChI=1S/C19H15F3N4O3.C7H8O3S.H2O/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);1H2;   InChIKey=SSULTCPIIYRGFQ-UHFFFAOYSA-N;   Ozex;   SMILES=O.Cc1ccc(cc1)S(O)(=O)=O.NC1CCN(C1)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)-c1ccc(F)cc1F;   Tosufloxacin tosylate monohydrate;   rac-tosufloxacin tosylate hydrate;   racemic tosufloxacin tosylate hydrate;   tosufloxacin monotosylate monohydrate
 xref: CAS:1400591-39-0;   KEGG:D01996;   Wikipedia:Tosufloxacin


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  CHEBI ontology 26827
    role 26655
      biological role 26634
        antimicrobial agent 22615
          tosufloxacin tosylate hydrate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26827
    subatomic particle 26803
      composite particle 26803
        hadron 26803
          baryon 26803
            nucleon 26803
              atomic nucleus 26803
                atom 26803
                  main group element atom 26554
                    main group molecular entity 26554
                      s-block molecular entity 25596
                        hydrogen molecular entity 25029
                          hydrides 23196
                            inorganic hydride 20797
                              pnictogen hydride 20742
                                nitrogen hydride 20506
                                  ammonium 8238
                                    ammonium ion derivative 8233
                                      1-[6-carboxy-8-(2,4-difluorophenyl)-3-fluoro-5-oxo-5,8-dihydro-1,8-naphthyridin-2-yl]pyrrolidin-3-aminium 0
                                        (S)-tosufloxacin(1+) 0
                                          (S)-tosufloxacin tosylate 0
                                            (S)-tosufloxacin tosylate hydrate 0
                                              tosufloxacin tosylate hydrate 0
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