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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:Paspaclavine
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Accession:CHEBI:215452 term browser browse the term
Synonyms:exact_synonym: (2R,3R,5R,7R)-5,6-dimethyl-3-prop-1-en-2-yl-4-oxa-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),9,12,14-tetraene
 related_synonym: Formula=C18H22N2O;   InChI=1S/C18H22N2O/c1-10(2)18-17-13-6-5-7-14-16(13)12(9-19-14)8-15(17)20(4)11(3)21-18/h5-7,9,11,15,17-19H,1,8H2,2-4H3/t11-,15-,17-,18+/m1/s1;   InChIKey=KBOWIUHISHXEEI-PTFKWJCZSA-N;   SMILES=O1[C@@H](C(=C)C)[C@@H]2C3=C4C(NC=C4C[C@H]2N([C@H]1C)C)=CC=C3
 xref: Chemspider:157602


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 22194
    role 22179
      biological role 22178
        biochemical role 21454
          metabolite 21402
            alkaloid 7901
              Paspaclavine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22194
    subatomic particle 22186
      composite particle 22186
        hadron 22186
          baryon 22186
            nucleon 22186
              atomic nucleus 22186
                atom 22186
                  main group element atom 22120
                    main group molecular entity 22120
                      p-block molecular entity 22120
                        carbon group molecular entity 21921
                          organic molecular entity 21847
                            heteroorganic entity 21503
                              organonitrogen compound 19827
                                alkaloid 7901
                                  Paspaclavine 0
paths to the root