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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:bis(2-ethylhexyl) adipate
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Accession:CHEBI:34675 term browser browse the term
Definition:A diester resulting from the formal condensation of the carboxy groups of adipic acid with 2-ethylhexan-1-ol. It is used as a plasticiser in the preparation of various polymers.
Synonyms:related_synonym: BEHA;   DEHA;   Di(2-ethylhexyl) adipate;   Diethylhexyl adipate;   Dioctyl adipate;   Formula=C22H42O4;   InChI=1S/C22H42O4/c1-5-9-13-19(7-3)17-25-21(23)15-11-12-16-22(24)26-18-20(8-4)14-10-6-2/h19-20H,5-18H2,1-4H3;   InChIKey=SAOKZLXYCUGLFA-UHFFFAOYSA-N;   SMILES=CCCCC(CC)COC(=O)CCCCC(=O)OCC(CC)CCCC;   adipic acid bis(2-ethylhexyl) ester;   bis(2-ethylhexyl) hexanedioate
 xref: CAS:103-23-1;   HMDB:HMDB0040270;   KEGG:C14240
 xref_mesh: MESH:C013966
 xref: PMID:16303285;   PMID:23246700;   PMID:23356645;   PMID:24016063;   PMID:6697017;   PMID:7781821;   Reaxys:1803774;   Wikipedia:Bis(2-ethylhexyl)_adipate


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bis(2-ethylhexyl) adipate term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Grn granulin precursor decreases expression EXP dioctyl adipate results in decreased expression of GRN mRNA CTD PMID:16493179 NCBI chr10:87,387,672...87,393,777
Ensembl chr10:87,387,638...87,393,775 		JBrowse link
G Hsd11b1 hydroxysteroid 11-beta dehydrogenase 1 decreases activity ISO dioctyl adipate results in decreased activity of HSD11B1 protein CTD PMID:16184081 NCBI chr13:104,728,539...104,798,884
Ensembl chr13:104,728,539...104,788,687 		JBrowse link
G Nolc1 nucleolar and coiled-body phosphoprotein 1 decreases expression EXP dioctyl adipate results in decreased expression of NOLC1 mRNA CTD PMID:16493179 NCBI chr 1:244,921,275...244,932,089
Ensembl chr 1:244,921,377...244,932,088 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19922
    role 19894
      application 19735
        plasticiser 11394
          bis(2-ethylhexyl) adipate 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 19922
    subatomic particle 19892
      composite particle 19892
        hadron 19920
          baryon 19892
            nucleon 19920
              atomic nucleus 19892
                atom 19892
                  main group element atom 19866
                    p-block element atom 19866
                      carbon group element atom 19805
                        carbon atom 19802
                          organic molecular entity 19775
                            heteroorganic entity 19556
                              organochalcogen compound 19315
                                organooxygen compound 19205
                                  carbon oxoacid 18694
                                    carboxylic acid 18691
                                      monocarboxylic acid 18007
                                        fatty acid 16847
                                          fatty acid derivative 8975
                                            dicarboxylic fatty acid 2652
                                              adipic acid 5
                                                bis(2-ethylhexyl) adipate 3
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