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ONTOLOGY REPORT - ANNOTATIONS


Term:rosuvastatin
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Accession:CHEBI:38545 term browser browse the term
Definition:A dihydroxy monocarboxylic acid that is (6E)-7-{4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino]-6-(propan-2-yl)pyrimidin-5-yl} hept-6-enoic acid carrying two hydroxy substituents at positions 3 and 5 (the 3R,5S-diastereomer).
Synonyms:exact_synonym: (3R,5S,6E)-7-{4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino]-6-(propan-2-yl)pyrimidin-5-yl}-3,5-dihydroxyhept-6-enoic acid
 related_synonym: (3R,5S,6E)-7-(4-(4-fluorophenyl)-6-(1-methylethyl)-2-(ethyl(methylsulfonyl)amino)-5-pyrimidinyl)-3,5-dihydroxy-6-heptenoic acid;   (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}-3,5-dihydroxyhept-6-enoic acid;   Formula=C22H28FN3O6S;   InChI=1S/C22H28FN3O6S/c1-13(2)20-18(10-9-16(27)11-17(28)12-19(29)30)21(14-5-7-15(23)8-6-14)25-22(24-20)26(3)33(4,31)32/h5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30)/b10-9+/t16-,17-/m1/s1;   InChIKey=BPRHUIZQVSMCRT-VEUZHWNKSA-N;   SMILES=CC(C)c1nc(nc(-c2ccc(F)cc2)c1\\C=C\\[C@@H](O)C[C@@H](O)CC(O)=O)N(C)S(C)(=O)=O
 xref: Beilstein:9670765 "Beilstein";   CAS:287714-41-4 "ChemIDplus";   DrugBank:DB01098;   Drug_Central:2406 "DrugCentral";   HMDB:HMDB0015230;   KEGG:D08492
 xref_mesh: MESH:C422923
 xref: PMID:17970755 "Europe PMC";   PMID:18509206 "Europe PMC";   PMID:19724024 "Europe PMC";   PMID:19956889 "Europe PMC";   PMID:23806820 "Europe PMC";   PMID:23881596 "Europe PMC";   PMID:23944632 "Europe PMC";   PMID:24072337 "Europe PMC";   PMID:24076283 "Europe PMC";   PMID:24076297 "Europe PMC";   PMID:24156555 "Europe PMC";   PMID:24163149 "Europe PMC";   PMID:24230979 "Europe PMC";   PMID:24253250 "Europe PMC";   PMID:24259612 "Europe PMC";   PMID:24304551 "Europe PMC";   PMID:24333476 "Europe PMC";   PMID:24353409 "Europe PMC";   PMID:24410968 "Europe PMC";   PMID:24417785 "Europe PMC";   PMID:24434545 "Europe PMC";   PMID:24440231 "Europe PMC";   PMID:24440960 "Europe PMC";   PMID:24444439 "Europe PMC";   PMID:24452083 "Europe PMC";   PMID:24456217 "Europe PMC";   PMID:24467235 "Europe PMC";   Patent:US2013035316;   Reaxys:9670765 "Reaxys";   Wikipedia:Rosuvastatin
 cyclic_relationship: is_conjugate_acid_of CHEBI:77313


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rosuvastatin term browser
Symbol Object Name JBrowse Chr Start Stop Reference
G Nr1h4 nuclear receptor subfamily 1, group H, member 4 JBrowse link 7 30,003,429 30,162,095 RGD:15042865

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19734
    role 19680
      biological role 19678
        xenobiotic 18334
          rosuvastatin 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19734
    subatomic particle 19730
      composite particle 19730
        hadron 19730
          baryon 19730
            nucleon 19730
              atomic nucleus 19730
                atom 19730
                  main group element atom 19614
                    p-block element atom 19614
                      carbon group element atom 19506
                        carbon atom 19500
                          organic molecular entity 19500
                            organic group 18414
                              organic divalent group 18406
                                organodiyl group 18406
                                  carbonyl group 18295
                                    carbonyl compound 18295
                                      carboxylic acid 17963
                                        monocarboxylic acid 17265
                                          fatty acid 15819
                                            unsaturated fatty acid 895
                                              monounsaturated fatty acid 399
                                                heptenoic acid 1
                                                  hept-6-enoic acid 1
                                                    rosuvastatin 1
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