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The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at The data is made available under the Creative Commons License (CC 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:eugenol sulfate
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Accession:CHEBI:133570 term browser browse the term
Definition:A phenylpropanoid that is eugenol in which the phenolic hydrogen has been replaced by a sulfo group.
Synonyms:exact_synonym: 2-methoxy-4-(prop-2-en-1-yl)phenyl hydrogen sulfate
 related_synonym: 4-allyl-2-methoxyphenyl hydrogen sulfate;   Formula=C10H12O5S;   InChI=1S/C10H12O5S/c1-3-4-8-5-6-9(10(7-8)14-2)15-16(11,12)13/h3,5-7H,1,4H2,2H3,(H,11,12,13);   InChIKey=XWAZTQUZONPJEW-UHFFFAOYSA-N;   SMILES=OS(OC=1C=CC(=CC1OC)CC=C)(=O)=O;   sulfuric acid mono-(4-allyl-2-methoxy-phenyl ester)
 xref: CAS:95480-60-7;   Reaxys:3329536
 cyclic_relationship: is_conjugate_acid_of CHEBI:133571

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Term Annotations click to browse term
  CHEBI ontology 21475
    role 21452
      biological role 21451
        aetiopathogenetic role 20539
          sensitiser 9997
            eugenol 1312
              eugenol sulfate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 21475
    subatomic particle 21460
      composite particle 21460
        hadron 21460
          baryon 21460
            nucleon 21460
              atomic nucleus 21460
                atom 21460
                  main group element atom 21361
                    p-block element atom 21361
                      carbon group element atom 21148
                        carbon atom 21046
                          organic molecular entity 21046
                            organic molecule 20936
                              organic cyclic compound 20495
                                carbocyclic compound 19119
                                  benzenoid aromatic compound 17778
                                    benzenes 17404
                                      methoxybenzenes 1848
                                        monomethoxybenzene 1750
                                          guaiacols 1372
                                            guaiacol 1323
                                              eugenol 1312
                                                eugenol sulfate 0
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