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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:gardneramine-N(4)-oxide
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Accession:CHEBI:67520 term browser browse the term
Definition:A tropane alkaloid that has formula C23H28N2O6.
Synonyms:related_synonym: Formula=C23H28N2O6;   InChI=1S/C23H28N2O6/c1-27-6-5-12-10-25(26)15-9-23-18(25)7-13(12)14(15)11-31-22(23)24-20-16(28-2)8-17(29-3)21(30-4)19(20)23/h5,8,13-15,18H,6-7,9-11H2,1-4H3/b12-5+/t13-,14-,15-,18-,23-,25?/m0/s1;   InChIKey=KYRGYFIBUVLRAO-WBZVWLCISA-N;   SMILES=[H][C@]12C[C@@]3([H])[C@]45C[C@@]([H])([C@@]1([H])COC4=Nc1c(OC)cc(OC)c(OC)c51)[N+]3([O-])C\\C2=C/COC
 xref: PMID:21425787

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  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            gardneramine-N(4)-oxide 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    main group molecular entity 0
                      s-block molecular entity 0
                        hydrogen molecular entity 0
                          hydrides 0
                            inorganic hydride 0
                              pnictogen hydride 0
                                nitrogen hydride 0
                                  azane 0
                                    ammonia 0
                                      organic amino compound 0
                                        tertiary amino compound 0
                                          tertiary amine oxide 0
                                            gardneramine-N(4)-oxide 0
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