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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:thymol sulfate
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Accession:CHEBI:82911 term browser browse the term
Definition:An organic sulfate of thymol.
Synonyms:exact_synonym: 5-methyl-2-(propan-2-yl)phenyl hydrogen sulfate
 related_synonym: Formula=C10H14O4S;   InChI=1S/C10H14O4S/c1-7(2)9-5-4-8(3)6-10(9)14-15(11,12)13/h4-7H,1-3H3,(H,11,12,13);   InChIKey=NODSEPOUFZPJEQ-UHFFFAOYSA-N;   SMILES=CC(C)c1ccc(C)cc1OS(O)(=O)=O
 xref: PMID:11863281;   PMID:12092740;   PMID:22939267;   Reaxys:3312332
 cyclic_relationship: is_conjugate_acid_of CHEBI:133663


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19840
    role 19790
      biological role 19790
        biochemical role 19328
          volatile oil component 5998
            thymol 39
              thymol sulfate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19840
    subatomic particle 19838
      composite particle 19838
        hadron 19838
          baryon 19838
            nucleon 19838
              atomic nucleus 19838
                atom 19838
                  main group element atom 19730
                    p-block element atom 19730
                      chalcogen 19424
                        oxygen atom 19386
                          oxygen molecular entity 19386
                            hydroxides 19111
                              oxoacid 18243
                                chalcogen oxoacid 11488
                                  sulfur oxoacid 11092
                                    sulfuric acid 8014
                                      sulfuric acid derivative 8014
                                        sulfates 8011
                                          organic sulfate 1946
                                            aryl sulfate 54
                                              thymol sulfate 0
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