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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 chr10:90,377,103...90,383,207
Ensembl chr10:90,376,933...90,383,205
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 chr13:111,946,626...111,996,536
Ensembl chr13:111,926,442...111,972,603
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 1:265,829,055...265,839,819
Ensembl chr 1:265,829,108...265,839,818
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19816
    role 19764
      application 19426
        plasticiser 7297
          bis(2-ethylhexyl) adipate 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 19816
    subatomic particle 19814
      composite particle 19814
        hadron 19814
          baryon 19814
            nucleon 19814
              atomic nucleus 19814
                atom 19814
                  main group element atom 19702
                    p-block element atom 19702
                      carbon group element atom 19608
                        carbon atom 19597
                          organic molecular entity 19597
                            organic group 18537
                              organic divalent group 18530
                                organodiyl group 18530
                                  carbonyl group 18436
                                    carbonyl compound 18436
                                      dicarboxylic acids and O-substituted derivatives 10279
                                        dicarboxylic acid 10272
                                          alpha,omega-dicarboxylic acid 2777
                                            adipic acid 5
                                              bis(2-ethylhexyl) adipate 3
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