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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:(S)-canadine
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Accession:CHEBI:16592 term browser browse the term
Definition:The (S)-enantiomer of canadine.
Synonyms:exact_synonym: (13aS)-9,10-dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline
 related_synonym: (13aS)-5,8,13,13a-Tetrahydro-9,10-dimethoxy-6H-Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine;   (S)-Tetrahydroberberine;   Formula=C20H21NO4;   InChI=1S/C20H21NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,8-9,16H,5-7,10-11H2,1-2H3/t16-/m0/s1;   InChIKey=VZTUIEROBZXUFA-INIZCTEOSA-N;   SMILES=[H][C@@]12Cc3ccc(OC)c(OC)c3CN1CCc1cc3OCOc3cc21;   canadine l-form
 alt_id: CHEBI:11059;   CHEBI:11074;   CHEBI:18773;   CHEBI:413
 xref: Beilstein:96684;   CAS:5096-57-1;   KEGG:C03329;   KNApSAcK:C00028005;   PMID:21661731;   Reaxys:96684
 cyclic_relationship: is_enantiomer_of CHEBI:18146


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19773
    role 19719
      biological role 19719
        pharmacological role 18831
          anti-obesity agent 455
            (S)-nandinine 0
              (S)-canadine 0
                (13S,14R)-1,13-dihydroxy-N-methylcanadine + 0
                (S)-N-methylcanadine + 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19773
    subatomic particle 19772
      composite particle 19772
        hadron 19772
          baryon 19772
            nucleon 19772
              atomic nucleus 19772
                atom 19772
                  main group element atom 19662
                    main group molecular entity 19662
                      s-block molecular entity 19426
                        hydrogen molecular entity 19420
                          hydrides 18753
                            inorganic hydride 17457
                              pnictogen hydride 17433
                                nitrogen hydride 17280
                                  azane 17015
                                    ammonia 17014
                                      organic amino compound 17013
                                        tertiary amino compound 8671
                                          (S)-nandinine 0
                                            (S)-canadine 0
                                              (13S,14R)-1,13-dihydroxy-N-methylcanadine + 0
                                              (S)-N-methylcanadine + 0
paths to the root