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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:(+)-Tetrandrine
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Accession:CHEBI:49 term browser browse the term
Definition:A bisbenzylisoquinoline alkaloid that has formula C38H42N2O6.
Synonyms:related_synonym: Formula=C38H42N2O6;   InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30-/m0/s1;   InChIKey=WVTKBKWTSCPRNU-KYJUHHDHSA-N;   SMILES=COc1ccc2C[C@@H]3N(C)CCc4cc(OC)c(OC)c(Oc5cc6[C@H](Cc7ccc(Oc1c2)cc7)N(C)CCc6cc5OC)c34
 xref: CAS:518-34-3;   KEGG:C09654;   KNApSAcK:C00001919;   KNApSAcK:C00025278;   LINCS:LSM-6539
 xref_mesh: MESH:C009438


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 5163
    role 5116
      biological role 5130
        biochemical role 5053
          metabolite 5028
            alkaloid 79
              isoquinoline alkaloid 1
                benzylisoquinoline alkaloid 1
                  bisbenzylisoquinoline alkaloid 1
                    (+)-Tetrandrine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5163
    subatomic particle 5140
      composite particle 5154
        hadron 5154
          baryon 5154
            nucleon 5154
              atomic nucleus 5154
                atom 5154
                  main group element atom 5113
                    p-block element atom 5110
                      carbon group element atom 5028
                        carbon atom 5027
                          organic molecular entity 5027
                            heteroorganic entity 4873
                              organonitrogen compound 413
                                alkaloid 79
                                  isoquinoline alkaloid 1
                                    benzylisoquinoline alkaloid 1
                                      bisbenzylisoquinoline alkaloid 1
                                        (+)-Tetrandrine 0
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