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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:taurocholate
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Accession:CHEBI:36257 term browser browse the term
Definition:An organosulfonate oxoanion that is the conjugate base of taurocholic acid.
Synonyms:exact_synonym: 2-[(3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonate
 related_synonym: Formula=C26H44NO7S;   InChI=1S/C26H45NO7S/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34)/p-1/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-/m1/s1;   InChIKey=WBWWGRHZICKQGZ-HZAMXZRMSA-M;   SMILES=[H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])C[C@H](O)[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])[C@H](O)C2)[C@H](C)CCC(=O)NCCS([O-])(=O)=O
 xref: Beilstein:3919947;   Reaxys:3919947
 cyclic_relationship: is_conjugate_base_of CHEBI:28865


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sodium taurocholate term browser
Symbol Object Name Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Serpinf1 serpin family F member 1 EXP taurocholate decreased activity of Serpinf1 protein in plasma RGD PMID:10360224 RGD:8661651 NCBI chr10:62,241,750...62,254,145
Ensembl chr10:62,241,756...62,254,287
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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19786
    chemical entity 19786
      molecular entity 19784
        ion 15941
          anion 14967
            organic anion 3037
              cholanic acid conjugate anion 1
                taurocholate 1
                  sodium taurocholate 1
                  taurocholate 7-sulfate(2-) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19786
    subatomic particle 19784
      composite particle 19784
        hadron 19784
          baryon 19784
            nucleon 19784
              atomic nucleus 19784
                atom 19784
                  main group element atom 19675
                    p-block element atom 19675
                      chalcogen 19413
                        oxygen atom 19378
                          oxygen molecular entity 19378
                            oxide 11754
                              oxoanion 8883
                                chalcogen oxoanion 541
                                  sulfur oxoanion 540
                                    sulfonate 29
                                      organosulfonate oxoanion 29
                                        taurocholate 1
                                          sodium taurocholate 1
                                          taurocholate 7-sulfate(2-) 0
paths to the root