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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:1,8-diaminooctane
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Accession:CHEBI:73112 term browser browse the term
Definition:An alkane-α,ω-diamine in which the two amino groups are separated by eight methylene groups.
Synonyms:related_synonym: 1,8-Octamethylenediamine;   1,8-Octylenediamine;   1,8-octanediamine;   Octamethylenediamine;   alpha,omega-diaminooctane;   octane-1,8-diamine
 xref: CAS:373-44-4;   Reaxys:1735426;   metacyc.compound:18-DIAMINOOCTANE
 chemrof_formula: C8H20N2
 chemrof_inchi: InChI=1S/C8H20N2/c9-7-5-3-1-2-4-6-8-10/h1-10H2
 chemrof_smiles: NCCCCCCCCN
 chemrof_inchikey: PWGJDPKCLMLPJW-UHFFFAOYSA-N
 cyclic_relationship: has_parent_hybride CHEBI:17590


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20874
    role 20844
      chemical role 20219
        acceptor 17380
          Bronsted base 17175
            organic amino compound 17164
              polyamine 5675
                diamine 5582
                  primary diamine 141
                    alkane-alpha,omega-diamine 32
                      1,8-diaminooctane 0
                        guazatine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 20874
    subatomic particle 20883
      composite particle 20883
        hadron 20872
          baryon 20883
            nucleon 20872
              atomic nucleus 20883
                atom 20872
                  main group element atom 20796
                    p-block element atom 20796
                      carbon group element atom 20712
                        carbon atom 20706
                          organic molecular entity 20706
                            heteroorganic entity 20201
                              organonitrogen compound 19311
                                organic amino compound 17164
                                  polyamine 5675
                                    diamine 5582
                                      primary diamine 141
                                        alkane-alpha,omega-diamine 32
                                          1,8-diaminooctane 0
                                            guazatine 0
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