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ONTOLOGY REPORT - ANNOTATIONS


Term:quinine(1+)
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Accession:CHEBI:137041 term browser browse the term
Definition:The monoprotonated form of quinine, the predominant species at pH7.3.
Synonyms:exact_synonym: (9R)-9-hydroxy-6'-methoxy-8alpha-cinchonan-1-ium
 related_synonym: Formula=C20H25N2O2;   InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/p+1/t13-,14-,19-,20+/m0/s1;   InChIKey=LOUPRKONTZGTKE-WZBLMQSHSA-O;   SMILES=[H][C@]1(C[C@@H]2CC[N@H+]1C[C@@H]2C=C)[C@H](O)c1ccnc2ccc(OC)cc12;   quinine
 cyclic_relationship: is_conjugate_acid_of CHEBI:15854


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19679
    chemical entity 19677
      molecular entity 19674
        ion 16490
          organic ion 7857
            organic cation 7082
              quinine(1+) 0
                3-hydroxyquinine 0
                quinine sulfate + 0
                quininyl group 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19679
    subatomic particle 19675
      composite particle 19675
        hadron 19675
          baryon 19675
            nucleon 19675
              atomic nucleus 19675
                atom 19675
                  main group element atom 19555
                    p-block element atom 19555
                      carbon group element atom 19438
                        carbon atom 19430
                          organic molecular entity 19430
                            organic molecule 19353
                              organic cyclic compound 19102
                                organic heterocyclic compound 18170
                                  organonitrogen heterocyclic compound 16978
                                    quinolines 2407
                                      (8xi)-cinchonan 64
                                        (8S)-cinchonan 24
                                          quinine(1+) 0
                                            3-hydroxyquinine 0
                                            quinine sulfate + 0
                                            quininyl group 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.