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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:DON-sulfonate 1
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Accession:CHEBI:149440 term browser browse the term
Synonyms:related_synonym: Formula=C15H22O9S;   InChI=1S/C15H22O9S/c1-12-4-15(20)9-6(17)3-13(15,2)14(5-16,8(19)7(12)18)10(24-9)11(12)25(21,22)23/h6,8-11,16-17,19-20H,3-5H2,1-2H3,(H,21,22,23)/t6-,8-,9-,10-,11-,12-,13-,14+,15+/m1/s1;   InChIKey=JIIXARIDFRURMK-WTLFXYAASA-N;   SMILES=C1[C@]2([C@]3([C@@]4([C@@]([C@H]([C@@]1(C)C([C@H]4O)=O)S(O)(=O)=O)(O[C@@]2([C@H](O)C3)[H])[H])CO)C)O;   deoxynivalenol sulfonate 1


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19841
    role 19817
      biological role 19815
        poison 18618
          toxin 15980
            mycotoxin 12017
              deoxynivalenol 870
                DON-sulfonate 1 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19841
    subatomic particle 19839
      composite particle 19839
        hadron 19839
          baryon 19839
            nucleon 19839
              atomic nucleus 19839
                atom 19839
                  main group element atom 19789
                    p-block element atom 19789
                      carbon group element atom 19737
                        carbon atom 19733
                          organic molecular entity 19733
                            heteroorganic entity 19492
                              organochalcogen compound 19255
                                organooxygen compound 19172
                                  carbonyl compound 18898
                                    ketone 17187
                                      oxyketone 8905
                                        alpha-oxyketone 8905
                                          alpha-hydroxy ketone 8905
                                            secondary alpha-hydroxy ketone 1038
                                              deoxynivalenol 870
                                                DON-sulfonate 1 0
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