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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 19821
    role 19769
      application 19481
        plasticiser 7388
          bis(2-ethylhexyl) adipate 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 19821
    subatomic particle 19819
      composite particle 19819
        hadron 19819
          baryon 19819
            nucleon 19819
              atomic nucleus 19819
                atom 19819
                  main group element atom 19716
                    p-block element atom 19716
                      carbon group element atom 19640
                        carbon atom 19630
                          organic molecular entity 19630
                            organic group 18737
                              organic divalent group 18728
                                organodiyl group 18728
                                  carbonyl group 18675
                                    carbonyl compound 18675
                                      dicarboxylic acids and O-substituted derivatives 10366
                                        dicarboxylic acid 10358
                                          alpha,omega-dicarboxylic acid 2796
                                            adipic acid 5
                                              bis(2-ethylhexyl) adipate 3
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