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ONTOLOGY REPORT - ANNOTATIONS


Term:CNDAC
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Accession:CHEBI:145435 term browser browse the term
Definition:A pyrimidine 2'-deoxyribonucleoside that is 2'-deoxycytidine having a cyano group in the 2'-position. It is the active metabolite of the anti-cancer drug, sapacitabine which is currently in clinical development for the treatment of hematologic malignancies and solid tumors.
Synonyms:exact_synonym: 4-amino-1-(2-cyano-2-deoxy-beta-D-arabinofuranosyl)pyrimidin-2(1H)-one
 related_synonym: 1-(2-deoxy-2-cyano-beta-D-arabinofuranosyl)cytosine;   2'-C-cyano-2'-deoxy-1-beta-D-arabino-pentofuranosyl-cytosine;   DFP10917;   Formula=C10H12N4O4;   InChI=1S/C10H12N4O4/c11-3-5-8(16)6(4-15)18-9(5)14-2-1-7(12)13-10(14)17/h1-2,5-6,8-9,15-16H,4H2,(H2,12,13,17)/t5-,6+,8-,9+/m0/s1;   InChIKey=DCYBPMFXJCWXNB-JWIUVKOKSA-N;   SMILES=O1[C@@H]([C@H]([C@@H]([C@@H]1N2C(N=C(C=C2)N)=O)C#N)O)CO;   TAS 109
 xref: CAS:135598-68-4 "ChemIDplus";   DrugBank:DB11667;   PMID:20587622 "Europe PMC";   PMID:22739266 "Europe PMC";   PMID:23049558 "Europe PMC";   PMID:27474148 "Europe PMC";   PMID:28802254 "Europe PMC";   PMID:29189915 "Europe PMC";   PMID:31501277 "Europe PMC";   PMID:8611048 "Europe PMC"


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19748
    chemical entity 19746
      group 19653
        pseudohalo group 2775
          cyano group 2775
            nitrile 2775
              CNDAC 0
                sapacitabine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19748
    subatomic particle 19744
      composite particle 19744
        hadron 19744
          baryon 19744
            nucleon 19744
              atomic nucleus 19744
                atom 19744
                  main group element atom 19628
                    p-block element atom 19628
                      carbon group element atom 19522
                        carbon atom 19516
                          organic molecular entity 19516
                            heteroorganic entity 19080
                              organochalcogen compound 18795
                                organooxygen compound 18707
                                  carbohydrates and carbohydrate derivatives 12113
                                    carbohydrate 12113
                                      carbohydrate derivative 11736
                                        glycosyl compound 10792
                                          N-glycosyl compound 5314
                                            nucleoside 5176
                                              deoxyribonucleoside 2705
                                                2'-deoxyribonucleoside 2188
                                                  pyrimidine 2'-deoxyribonucleoside 333
                                                    CNDAC 0
                                                      sapacitabine 0
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