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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:(1S,5R)-6-(cyclopropylmethyl)-7-(4-pyridin-4-ylphenyl)-3,6-diazabicyclo[3.1.1]heptane
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Accession:CHEBI:130343 term browser browse the term
Definition:A piperidine that has formula C20H23N3.
Synonyms:related_synonym: Formula=C20H23N3;   InChI=1S/C20H23N3/c1-2-14(1)13-23-18-11-22-12-19(23)20(18)17-5-3-15(4-6-17)16-7-9-21-10-8-16/h3-10,14,18-20,22H,1-2,11-13H2/t18-,19+,20?;   InChIKey=QGZAQQVKABBKJZ-YOFSQIOKSA-N;   SMILES=C1CC1CN2[C@@H]3CNC[C@H]2C3C4=CC=C(C=C4)C5=CC=NC=C5
 xref: LINCS:LSM-41892


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Path 1
Term Annotations click to browse term
  CHEBI ontology 5177
    chemical entity 5177
      atom 5168
        nonmetal atom 5134
          nitrogen atom 531
            nitrogen molecular entity 531
              organonitrogen compound 415
                organonitrogen heterocyclic compound 298
                  piperidines 22
                    (1S,5R)-6-(cyclopropylmethyl)-7-(4-pyridin-4-ylphenyl)-3,6-diazabicyclo[3.1.1]heptane 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5177
    subatomic particle 5168
      composite particle 5168
        hadron 5168
          baryon 5168
            nucleon 5168
              atomic nucleus 5168
                atom 5168
                  main group element atom 5140
                    p-block element atom 5137
                      carbon group element atom 5056
                        carbon atom 5055
                          organic molecular entity 5055
                            organic molecule 5003
                              organic cyclic compound 4943
                                organic heterocyclic compound 4730
                                  organic heteromonocyclic compound 4488
                                    piperidines 22
                                      (1S,5R)-6-(cyclopropylmethyl)-7-(4-pyridin-4-ylphenyl)-3,6-diazabicyclo[3.1.1]heptane 0
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