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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:1,4-bis(2-ethylhexyl) sulfosuccinate
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Accession:CHEBI:534 term browser browse the term
Definition:A succinate ester that has formula C20H38O7S.
Synonyms:related_synonym: 1,4-bis(2-ethylhexoxy)-1,4-bis(oxidanylidene)butane-2-sulfonic acid;   1,4-bis(2-ethylhexoxy)-1,4-diketo-butane-2-sulfonic acid;   1,4-bis(2-ethylhexoxy)-1,4-dioxo-2-butanesulfonic acid;   1,4-bis(2-ethylhexoxy)-1,4-dioxo-butane-2-sulfonic acid;   1,4-bis(2-ethylhexoxy)-1,4-dioxobutane-2-sulfonic acid;   1,4-bis[(2-ethylhexyl)oxy]-1,4-dioxobutane-2-sulfonic acid;   1-(2-Methylphenyl)ethanone;   1-(2-Tolyl)ethanone;   1-(Methylphenyl)-Ethanone;   1-(Methylphenyl)ethan-1-one;   2'-Methyl-Acetophenone;   2'-Methylacetophenone;   2'-Methylacetylphenone;   2-Acetyltoluene;   Acetophenone, 2'-methyl- (8CI);   Docusate hydrogen;   Ethanone, 1-(2-methylphenyl)- (9CI);   Formula=C20H38O7S;   InChI=1S/C20H38O7S/c1-5-9-11-16(7-3)14-26-19(21)13-18(28(23,24)25)20(22)27-15-17(8-4)12-10-6-2/h16-18H,5-15H2,1-4H3,(H,23,24,25);   InChIKey=HNSDLXPSAYFUHK-UHFFFAOYSA-N;   Methyl O-tolyl ketone;   O-Acetyltoluene;   O-Methyl acetophenone;   O-Methylacetophenone;   SMILES=CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(O)(=O)=O;   dioctyl disodium sulfosuccinate;   dioctyl sulfosuccinate;   dioctyl sulfosuccinic acid;   docusate;   docusate calcium
 xref: CAS:10041-19-7;   CAS:577-16-2;   Drug_Central:941;   HMDB:HMDB0032386;   KEGG:C07874
 xref_mesh: MESH:D004143
 xref: PMID:19167006


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1,4-bis(2-ethylhexyl) sulfosuccinate term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Dlk1 delta like non-canonical Notch ligand 1 decreases expression ISO Dioctyl Sulfosuccinic Acid results in decreased expression of DLK1 mRNA CTD PMID:26135921 NCBI chr 6:133,576,513...133,583,751
Ensembl chr 6:133,552,821...133,583,751
JBrowse link
G Fabp4 fatty acid binding protein 4 increases expression ISO Dioctyl Sulfosuccinic Acid results in increased expression of FABP4 mRNA CTD PMID:26135921 NCBI chr 2:93,792,666...93,797,267
Ensembl chr 2:93,792,601...93,797,305
JBrowse link
G Ppara peroxisome proliferator activated receptor alpha increases activity ISO Dioctyl Sulfosuccinic Acid results in increased activity of PPARA protein CTD PMID:26135921 NCBI chr 7:126,618,872...126,687,282
Ensembl chr 7:126,619,196...126,681,752
JBrowse link
G Ppard peroxisome proliferator-activated receptor delta increases activity ISO Dioctyl Sulfosuccinic Acid results in increased activity of PPARD protein CTD PMID:26135921 NCBI chr20:7,818,289...7,883,482
Ensembl chr20:7,818,289...7,885,333
JBrowse link
G Pparg peroxisome proliferator-activated receptor gamma multiple interactions
increases activity
ISO Dioctyl Sulfosuccinic Acid binds to and results in increased activity of PPARG protein
Dioctyl Sulfosuccinic Acid results in increased activity of PPARG protein
CTD PMID:26135921 NCBI chr 4:147,274,055...147,399,383
Ensembl chr 4:147,274,107...147,399,380
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19817
    chemical entity 19817
      group 19728
        inorganic group 19174
          sulfo group 5752
            organosulfonic acid 5752
              1,4-bis(2-ethylhexyl) sulfosuccinate 5
Path 2
Term Annotations click to browse term
  CHEBI ontology 19817
    subatomic particle 19815
      composite particle 19815
        hadron 19815
          baryon 19815
            nucleon 19815
              atomic nucleus 19815
                atom 19815
                  main group element atom 19705
                    p-block element atom 19705
                      chalcogen 19407
                        oxygen atom 19368
                          oxygen molecular entity 19368
                            hydroxides 19094
                              oxoacid 18243
                                chalcogen oxoacid 11496
                                  sulfur oxoacid 11102
                                    sulfonic acid 7356
                                      sulfo group 5752
                                        organosulfonic acid 5752
                                          1,4-bis(2-ethylhexyl) sulfosuccinate 5
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