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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 19808
    role 19784
      application 19627
        plasticiser 7681
          bis(2-ethylhexyl) adipate 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 19808
    subatomic particle 19806
      composite particle 19806
        hadron 19806
          baryon 19806
            nucleon 19806
              atomic nucleus 19806
                atom 19806
                  main group element atom 19756
                    p-block element atom 19756
                      carbon group element atom 19705
                        carbon atom 19702
                          organic molecular entity 19702
                            heteroorganic entity 19460
                              organochalcogen compound 19224
                                organooxygen compound 19141
                                  carbon oxoacid 18612
                                    carboxylic acid 18609
                                      monocarboxylic acid 17984
                                        fatty acid 16792
                                          fatty acid derivative 8960
                                            dicarboxylic fatty acid 2650
                                              adipic acid 5
                                                bis(2-ethylhexyl) adipate 3
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