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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:Aspergone O
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Accession:CHEBI:227618 term browser browse the term
Synonyms:exact_synonym: (1R,2S,3S,4R)-3-chloro-5-(hydroxymethyl)-6-[(E)-prop-1-enyl]cyclohex-5-ene-1,2,4-triol
 related_synonym: Formula=C10H15ClO4;   InChI=1S/C10H15ClO4/c1-2-3-5-6(4-12)8(13)7(11)10(15)9(5)14/h2-3,7-10,12-15H,4H2,1H3/b3-2+/t7-,8+,9+,10+/m0/s1;   InChIKey=BBSVWCUYQGBLHU-PPVMYRAKSA-N;   SMILES=Cl[C@H]1[C@H](O)C(=C(/C=C/C)[C@H]([C@@H]1O)O)CO
 xref: Chemspider:40256853


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19832
    chemical entity 19830
      molecular entity 19830
        polyatomic entity 19788
          heteroatomic molecular entity 19744
            hydroxides 19321
              organic hydroxy compound 18949
                polyol 11707
                  cyclitol 7489
                    Aspergone O 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19832
    subatomic particle 19830
      composite particle 19830
        hadron 19830
          baryon 19830
            nucleon 19830
              atomic nucleus 19830
                atom 19830
                  main group element atom 19780
                    p-block element atom 19780
                      p-block molecular entity 19780
                        chalcogen molecular entity 19535
                          oxygen molecular entity 19510
                            hydroxides 19321
                              organic hydroxy compound 18949
                                polyol 11707
                                  cyclitol 7489
                                    Aspergone O 0
paths to the root