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ONTOLOGY REPORT - ANNOTATIONS


Term:dauricine
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Accession:CHEBI:4331 term browser browse the term
Definition:A bisbenzylisoquinoline alkaloid resulting from the formal oxidative dimerisation of 4-{[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}phenol by attachment of the phenolic oxygen of one molecule to the benzene ring of the second (ortho to the phenolic hydroxy group of the latter).
Synonyms:exact_synonym: 4-{[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-2-(4-{[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}phenoxy)phenol
 related_synonym: Formula=C38H44N2O6;   InChI=1S/C38H44N2O6/c1-39-15-13-26-20-35(42-3)37(44-5)22-29(26)31(39)17-24-7-10-28(11-8-24)46-34-19-25(9-12-33(34)41)18-32-30-23-38(45-6)36(43-4)21-27(30)14-16-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m1/s1;   InChIKey=AQASRZOCERRGBL-ROJLCIKYSA-N;   SMILES=COc1cc2CCN(C)[C@H](Cc3ccc(Oc4cc(C[C@H]5N(C)CCc6cc(OC)c(OC)cc56)ccc4O)cc3)c2cc1OC
 xref: Beilstein:75683 "Beilstein";   CAS:524-17-4 "ChemIDplus";   CAS:524-17-4 "KEGG COMPOUND";   KEGG:C09419;   KNApSAcK:C00001845;   KNApSAcK:C00028131
 xref_mesh: MESH:C035934
 xref: Wikipedia:Dauricine


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  CHEBI ontology 19654
    role 19598
      application 19220
        refrigerant 16977
          ammonia 16548
            organic amino compound 16547
              tertiary amino compound 8517
                dauricine 0
                  guattegaumerine 0
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  CHEBI ontology 19654
    subatomic particle 19650
      composite particle 19650
        hadron 19650
          baryon 19650
            nucleon 19650
              atomic nucleus 19650
                atom 19650
                  main group element atom 19531
                    main group molecular entity 19531
                      s-block molecular entity 19314
                        hydrogen molecular entity 19303
                          hydrides 18231
                            inorganic hydride 17095
                              pnictogen hydride 17053
                                nitrogen hydride 16874
                                  azane 16551
                                    ammonia 16548
                                      organic amino compound 16547
                                        tertiary amino compound 8517
                                          dauricine 0
                                            guattegaumerine 0
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