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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:3-methoxytyramine sulfate
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Accession:CHEBI:133708 term browser browse the term
Definition:An aryl sulfate that is 3-methoxytyramine in which the phenolic hydrogen has been replaced by a sulfo group.
Synonyms:exact_synonym: 4-(2-aminoethyl)-2-methoxyphenyl hydrogen sulfate
 related_synonym: Formula=C9H13NO5S;   InChI=1S/C9H13NO5S/c1-14-9-6-7(4-5-10)2-3-8(9)15-16(11,12)13/h2-3,6H,4-5,10H2,1H3,(H,11,12,13);   InChIKey=ORZHQEJEAKXCJA-UHFFFAOYSA-N;   SMILES=C(CC=1C=C(C(=CC1)OS(O)(=O)=O)OC)N
 xref: Reaxys:2741263
 cyclic_relationship: is_tautomer_of CHEBI:133709


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  CHEBI ontology 19770
    role 19720
      application 19411
        refrigerant 17469
          ammonia 17002
            organic amino compound 17001
              primary amino compound 7907
                3-methoxytyramine sulfate 0
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  CHEBI ontology 19770
    subatomic particle 19768
      composite particle 19768
        hadron 19768
          baryon 19768
            nucleon 19768
              atomic nucleus 19768
                atom 19768
                  main group element atom 19662
                    p-block element atom 19662
                      chalcogen 19391
                        oxygen atom 19354
                          oxygen molecular entity 19354
                            hydroxides 19077
                              oxoacid 18278
                                chalcogen oxoacid 11495
                                  sulfur oxoacid 11101
                                    sulfuric acid 8020
                                      sulfuric acid derivative 8020
                                        sulfates 8017
                                          organic sulfate 1944
                                            aryl sulfate 54
                                              3-methoxytyramine sulfate 0
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