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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 19740
    role 19713
      application 19546
        plasticiser 7433
          bis(2-ethylhexyl) adipate 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 19740
    subatomic particle 19738
      composite particle 19738
        hadron 19738
          baryon 19738
            nucleon 19738
              atomic nucleus 19738
                atom 19738
                  main group element atom 19686
                    p-block element atom 19686
                      carbon group element atom 19631
                        carbon atom 19627
                          organic molecular entity 19627
                            organic group 18846
                              organic divalent group 18832
                                organodiyl group 18832
                                  carbonyl group 18798
                                    carbonyl compound 18798
                                      carboxylic acid 18518
                                        monocarboxylic acid 17852
                                          fatty acid 16519
                                            fatty acid derivative 8893
                                              dicarboxylic fatty acid 2640
                                                adipic acid 5
                                                  bis(2-ethylhexyl) adipate 3
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