Send us a Message



Submit Data |  Help |  Video Tutorials |  News |  Publications |  Download |  REST API |  Citing RGD |  Contact   

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
go back to main search page
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



show annotations for term's descendants           Sort by:

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19899
    role 19870
      biological role 19868
        antimicrobial agent 18273
          tosufloxacin tosylate hydrate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19899
    subatomic particle 19897
      composite particle 19897
        hadron 19897
          baryon 19897
            nucleon 19897
              atomic nucleus 19897
                atom 19897
                  main group element atom 19836
                    main group molecular entity 19836
                      s-block molecular entity 19670
                        hydrogen molecular entity 19652
                          hydrides 19162
                            inorganic hydride 18180
                              pnictogen hydride 18170
                                nitrogen hydride 18083
                                  ammonium 8327
                                    ammonium ion derivative 8322
                                      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
paths to the root