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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:thalicpureine
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Accession:CHEBI:143869 term browser browse the term
Definition:A phenanthrene substituted by a 2-(methylamino)ethyl group at position 1 and by methoxy groups at positions 2,3,4,6 and 7, respectively. It is a plant metabolite isolated from Annona purpurea and Fagonia olivieri.
Synonyms:exact_synonym: N-methyl-2-(2,3,4,6,7-pentamethoxyphenanthren-1-yl)ethan-1-amine;   N-methyl-2-(2,3,4,6,7-pentamethoxyphenanthren-1-yl)ethanamine
 related_synonym: Formula=C22H27NO5;   InChI=1S/C22H27NO5/c1-23-10-9-15-14-8-7-13-11-17(24-2)18(25-3)12-16(13)19(14)21(27-5)22(28-6)20(15)26-4/h7-8,11-12,23H,9-10H2,1-6H3;   InChIKey=VMIFHEUVQQHIOK-UHFFFAOYSA-N;   SMILES=O(C1=C2C(=C(CCNC)C(OC)=C1OC)C=CC=3C2=CC(OC)=C(OC)C3)C;   methyl[2-(2,3,4,6,7-pentamethoxyphenanthren-1-yl)ethyl]amine
 xref: CAS:218900-91-5;   FooDB:FDB011024;   HMDB:HMDB0033032;   KNApSAcK:C00050253;   PMID:28122313;   PMID:9868142

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  CHEBI ontology 0
    role 0
      biological role 0
        xenobiotic 0
          phenanthrenes 0
            thalicpureine 0
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  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
                    main group molecular entity 0
                      s-block molecular entity 0
                        hydrogen molecular entity 0
                          hydrides 0
                            inorganic hydride 0
                              pnictogen hydride 0
                                nitrogen hydride 0
                                  azane 0
                                    ammonia 0
                                      organic amino compound 0
                                        secondary amino compound 0
                                          thalicpureine 0
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