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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:amikacin disulfate
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Accession:CHEBI:2638 term browser browse the term
Definition:An aminoglycoside sulfate salt obtained by combining amikacin with two molar equivalents of sulfuric acid.
Synonyms:exact_synonym: (2S)-4-amino-N-[(1R,2S,3S,4R,5S)-5-amino-2-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-4-(6-amino-6-deoxy-alpha-D-glucopyranosyloxy)-3-hydroxycyclohexyl]-2-hydroxybutanamide disulfate
 related_synonym: Amikacin sulfate;   Amikan;   Amikin;   Formula=C22H47N5O21S2;   InChI=1S/C22H43N5O13.2H2O4S/c23-2-1-8(29)20(36)27-7-3-6(25)18(39-22-16(34)15(33)13(31)9(4-24)37-22)17(35)19(7)40-21-14(32)11(26)12(30)10(5-28)38-21;2*1-5(2,3)4/h6-19,21-22,28-35H,1-5,23-26H2,(H,27,36);2*(H2,1,2,3,4)/t6-,7+,8-,9+,10+,11-,12+,13+,14+,15-,16+,17-,18+,19-,21+,22+;;/m0../s1;   InChIKey=FXKSEJFHKVNEFI-GCZBSULCSA-N;   O-3-amino-3-deoxy-alpha-D-glucopyranosyl-(1->4)-O-(6-amino-6-deoxy-alpha-D-glucopyranosyl-(1->6))-N(3)-(4-amino-L-2-hydroxybutyryl)-2-deoxy-L-streptamine sulfate (1:2);   Pierami;   SMILES=OS(O)(=O)=O.OS(O)(=O)=O.NCC[C@H](O)C(=O)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](N)[C@H]1O;   amikacin bis(sulphate);   amikacin disulphate
 xref: Beilstein:6172633;   CAS:39831-55-5;   DrugBank:DB00479;   KEGG:D00865;   PMID:109983;   PMID:3174816;   PMID:6162275;   PMID:6800084;   Reaxys:6172633


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  CHEBI ontology 19917
    role 19887
      biological role 19885
        antimicrobial agent 18274
          amikacin disulfate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19917
    subatomic particle 19915
      composite particle 19915
        hadron 19915
          baryon 19915
            nucleon 19915
              atomic nucleus 19915
                atom 19915
                  main group element atom 19855
                    p-block element atom 19855
                      chalcogen 19583
                        oxygen atom 19576
                          oxygen molecular entity 19576
                            hydroxides 19380
                              oxoacid 18792
                                chalcogen oxoacid 13794
                                  sulfur oxoacid 13583
                                    sulfuric acid 8251
                                      sulfuric acid derivative 8251
                                        sulfates 8246
                                          sulfate salt 7137
                                            organic sulfate salt 220
                                              organoammonium sulfate salt 119
                                                aminoglycoside sulfate salt 115
                                                  amikacin disulfate 0
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