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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:6-propyl-2-thiouracil
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Accession:CHEBI:8502 term browser browse the term
Definition:A pyrimidinethione consisting of uracil in which the 2-oxo group is substituted by a thio group and the hydrogen at position 6 is substituted by a propyl group.
Synonyms:exact_synonym: 6-propyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
 related_synonym: 2,3-dihydro-6-propyl-2-thioxo-4(1H)-pyrimidinone;   2-Mercapto-6-propyl-4-pyrimidone;   2-Mercapto-6-propylpyrimid-4-one;   2-Thio-4-oxo-6-propyl-1,3-pyrimidine;   2-Thio-6-propyl-1,3-pyrimidin-4-one;   4-Propyl-2-thiouracil;   6-Propyl-2-thio-2,4(1H,3H)pyrimidinedione;   6-Propylthiouracil;   6-Thio-4-propyluracil;   6-propyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one;   Formula=C7H10N2OS;   InChI=1S/C7H10N2OS/c1-2-3-5-4-6(10)9-7(11)8-5/h4H,2-3H2,1H3,(H2,8,9,10,11);   InChIKey=KNAHARQHSZJURB-UHFFFAOYSA-N;   Propylthiouracil;   SMILES=CCCc1cc(=O)[nH]c(=S)[nH]1;   propiltiouracilo;   propylthiouracile;   propylthiouracilum
 xref: Beilstein:130039;   CAS:51-52-5;   DrugBank:DB00550;   Drug_Central:2308;   Gmelin:1998546;   HMDB:HMDB0014690;   KEGG:C07569;   KEGG:D00562;   LINCS:LSM-5592
 xref_mesh: MESH:D011441
 xref: PMID:11005705;   PMID:11036881;   PMID:11350963;   PMID:11401533;   PMID:12135875;   PMID:12922945;   PMID:14692727;   PMID:14745920;   PMID:16380675;   PMID:16498810;   PMID:16880639;   PMID:17365943;   PMID:17497002;   PMID:17878268;   PMID:18055877;   PMID:18710353;   PMID:19530273;   PMID:19578601;   PMID:20166204;   PMID:21749382;   PMID:6387489;   Reaxys:130039;   Wikipedia:Propylthiouracil


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      CHEBI ontology 19911
        role 19854
          chemical role 19507
            antioxidant 16171
              6-propyl-2-thiouracil 7342
                6-(2-hydroxyethyl)-2-sulfanylidene-1H-pyrimidin-4-one 0
    Path 2
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      CHEBI ontology 19911
        subatomic particle 19909
          composite particle 19909
            hadron 19880
              baryon 19880
                nucleon 19909
                  atomic nucleus 19880
                    atom 19909
                      main group element atom 19849
                        p-block element atom 19849
                          carbon group element atom 19766
                            carbon atom 19785
                              organic molecular entity 19785
                                organic molecule 19737
                                  organic cyclic compound 19526
                                    organic heterocyclic compound 18870
                                      organic heteromonocyclic compound 17791
                                        diazines 13203
                                          pyrimidines 13116
                                            pyrimidine nucleobase 8512
                                              uracil 8037
                                                6-propyl-2-thiouracil 7342
                                                  6-(2-hydroxyethyl)-2-sulfanylidene-1H-pyrimidin-4-one 0
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