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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:Apratastat
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Accession:CHEBI:177520 term browser browse the term
Synonyms:exact_synonym: (3S)-N-hydroxy-4-[4-(4-hydroxybut-2-ynoxy)phenyl]sulonyl-2,2-dimethylthiomorpholine-3-carboxamide
 related_synonym: Formula=C17H22N2O6S2;   InChI=1S/C17H22N2O6S2/c1-17(2)15(16(21)18-22)19(9-12-26-17)27(23,24)14-7-5-13(6-8-14)25-11-4-3-10-20/h5-8,15,20,22H,9-12H2,1-2H3,(H,18,21)/t15-/m0/s1;   InChIKey=MAVDNGWEBZTACC-HNNXBMFYSA-N;   SMILES=S1C([C@@H](N(S(=O)(=O)C2=CC=C(OCC#CCO)C=C2)CC1)C(=O)NO)(C)C
 xref: CAS:287405-51-0;   Chemspider:9627567;   DrugBank:DB13020;   KEGG:D08859
 xref_mesh: MESH:C484302


show annotations for term's descendants           Sort by:
Apratastat term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Sdc1 syndecan 1 decreases secretion ISO apratastat results in decreased secretion of SDC1 protein CTD PMID:19875451 NCBI chr 6:31,562,799...31,585,267
Ensembl chr 6:31,562,739...31,585,264 		JBrowse link
G Sdc4 syndecan 4 decreases secretion ISO apratastat results in decreased secretion of SDC4 protein CTD PMID:19875451 NCBI chr 3:153,154,888...153,173,576
Ensembl chr 3:153,154,896...153,173,580 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19874
    chemical entity 19872
      atom 19872
        nonmetal atom 19794
          sulfur atom 17750
            sulfur molecular entity 17750
              organosulfur compound 17449
                sulfonamide 5307
                  Apratastat 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19874
    subatomic particle 19872
      composite particle 19872
        hadron 19872
          baryon 19872
            nucleon 19872
              atomic nucleus 19872
                atom 19872
                  main group element atom 19811
                    p-block element atom 19811
                      chalcogen 19563
                        oxygen atom 19535
                          oxygen molecular entity 19535
                            hydroxides 19341
                              oxoacid 18777
                                chalcogen oxoacid 13781
                                  sulfur oxoacid 13570
                                    sulfonic acid 11616
                                      sulfonic acid derivative 11616
                                        sulfonamide 5307
                                          Apratastat 2
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