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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:1,3-bis(2-ethylhexyl)-5-methyl-1,3-diazinan-5-amine
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Accession:CHEBI:94339 term browser browse the term
Definition:An organic heteromonocyclic compound that has formula C21H45N3.
Synonyms:related_synonym: Formula=C21H45N3;   InChI=1S/C21H45N3/c1-6-10-12-19(8-3)14-23-16-21(5,22)17-24(18-23)15-20(9-4)13-11-7-2/h19-20H,6-18,22H2,1-5H3;   InChIKey=DTOUUUZOYKYHEP-UHFFFAOYSA-N;   SMILES=CCCCC(CC)CN1CC(CN(C1)CC(CC)CCCC)(C)N;   glypesin;   hexoral
 xref: CAS:141-94-6;   Drug_Central:3277;   LINCS:LSM-4988
 xref_mesh: MESH:D006590


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1,3-bis(2-ethylhexyl)-5-methyl-1,3-diazinan-5-amine term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Kcnh2 potassium voltage-gated channel subfamily H member 2 decreases activity ISO Hexetidine results in decreased activity of KCNH2 protein CTD PMID:28551711 NCBI chr 4:10,826,834...10,859,009
Ensembl chr 4:10,826,928...10,859,008 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19841
    chemical entity 19839
      atom 19839
        nonmetal atom 19777
          nitrogen atom 18962
            nitrogen molecular entity 18962
              organonitrogen compound 18812
                organonitrogen heterocyclic compound 18154
                  1,3-bis(2-ethylhexyl)-5-methyl-1,3-diazinan-5-amine 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19841
    subatomic particle 19839
      composite particle 19839
        hadron 19839
          baryon 19839
            nucleon 19839
              atomic nucleus 19839
                atom 19839
                  main group element atom 19789
                    p-block element atom 19789
                      carbon group element atom 19737
                        carbon atom 19733
                          organic molecular entity 19733
                            organic molecule 19686
                              organic cyclic compound 19498
                                organic heterocyclic compound 18876
                                  organic heteromonocyclic compound 17804
                                    1,3-bis(2-ethylhexyl)-5-methyl-1,3-diazinan-5-amine 1
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