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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: 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 22355
        role 22341
          chemical role 21588
            antioxidant 16479
              6-propyl-2-thiouracil 7203
                6-(2-hydroxyethyl)-2-sulfanylidene-1H-pyrimidin-4-one 0
    Path 2
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      CHEBI ontology 22355
        subatomic particle 22350
          composite particle 22350
            hadron 22350
              baryon 22350
                nucleon 22350
                  atomic nucleus 22350
                    atom 22350
                      main group element atom 22239
                        p-block element atom 22239
                          carbon group element atom 22044
                            carbon atom 21985
                              organic molecular entity 21985
                                organic molecule 21816
                                  organic cyclic compound 21447
                                    organic heterocyclic compound 20392
                                      organic heteromonocyclic compound 18777
                                        diazines 13471
                                          pyrimidines 13340
                                            pyrimidine nucleobase 8468
                                              uracil 7908
                                                6-propyl-2-thiouracil 7203
                                                  6-(2-hydroxyethyl)-2-sulfanylidene-1H-pyrimidin-4-one 0
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