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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 19880
    chemical entity 19878
      atom 19878
        nonmetal atom 19800
          nitrogen atom 18979
            nitrogen molecular entity 18979
              organonitrogen compound 18833
                organonitrogen heterocyclic compound 18153
                  1,3-bis(2-ethylhexyl)-5-methyl-1,3-diazinan-5-amine 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19880
    subatomic particle 19878
      composite particle 19878
        hadron 19878
          baryon 19878
            nucleon 19878
              atomic nucleus 19878
                atom 19878
                  main group element atom 19817
                    p-block element atom 19817
                      carbon group element atom 19757
                        carbon atom 19754
                          organic molecular entity 19754
                            organic molecule 19706
                              organic cyclic compound 19495
                                organic heterocyclic compound 18874
                                  organic heteromonocyclic compound 17795
                                    1,3-bis(2-ethylhexyl)-5-methyl-1,3-diazinan-5-amine 1
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