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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:senecionine
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Accession:CHEBI:9107 term browser browse the term
Definition:A pyrrolizidine alkaloid isolated from the plant species of the genus Senecio.
Synonyms:exact_synonym: 12-hydroxysenecionan-11,16-dione
 related_synonym: Formula=C18H25NO5;   InChI=1S/C18H25NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4-/t11-,14-,15-,18-/m1/s1;   InChIKey=HKODIGSRFALUTA-JTLQZVBZSA-N;   SMILES=[H]\\C(C)=C1/C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN3CC[C@@]([H])(OC1=O)[C@@]23[H];   Senecionin;   aureine
 xref: Beilstein:8162955;   Beilstein:934445;   Beilstein:94450;   CAS:130-01-8;   KEGG:C06176;   KNApSAcK:C00002116
 xref_mesh: MESH:C009237
 xref: PMID:15202562;   PMID:17260281;   PMID:21710732;   Reaxys:94450
 cyclic_relationship: is_conjugate_base_of CHEBI:77617

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Path 1
Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            alkaloid 0
              pyrrolizidine alkaloid 0
                senecionine 0
                  dehydrojacoline 0
                  jacoline + 0
                  senecionine N-oxide 0
Path 2
Term Annotations click to browse term
  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
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic molecule 0
                              organic cyclic compound 0
                                organic heterocyclic compound 0
                                  organic heteropolycyclic compound 0
                                    organic heterobicyclic compound 0
                                      pyrrolizines 0
                                        pyrrolizine alkaloid 0
                                          senecionan 0
                                            senecionine 0
                                              dehydrojacoline 0
                                              jacoline + 0
                                              senecionine N-oxide 0
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