{
  "iri" : "http://purl.obolibrary.org/obo/CHEBI_43060",
  "lang" : "en",
  "description" : [ "A pyrimidone that is thymine which is substituted at positions 1 and 6 by a (2-hydroxyethoxy)methyl group and a phenylsulfanyl group, respectively." ],
  "synonyms" : [ "1-[(2-hydroxyethoxy)methyl]-5-methyl-6-(phenylsulfanyl)pyrimidine-2,4(1H,3H)-dione", "1-(2-HYDROXYETHYLOXYMETHYL)-6-PHENYL THIOTHYMINE", "1-[(2-hydroxyethoxy)methyl]-6-(phenylthio)thymine", "1-[(2-hydroxyethoxy)methyl]-6-phenylthiothymine", "6-Hept", "HEPT", "HMPTT" ],
  "annotation" : {
    "charge" : [ "0" ],
    "formula" : [ "C14H16N2O4S" ],
    "has_dbxref" : [ "CAS:123027-56-5", "PDBeChem:HEF", "PMID:1683214", "PMID:17191775", "PMID:1992136", "Reaxys:4271052" ],
    "has_obo_namespace" : [ "chebi_ontology" ],
    "id" : [ "CHEBI:43060" ],
    "inchi" : [ "InChI=1S/C14H16N2O4S/c1-10-12(18)15-14(19)16(9-20-8-7-17)13(10)21-11-5-3-2-4-6-11/h2-6,17H,7-9H2,1H3,(H,15,18,19)" ],
    "inchikey" : [ "HDMHBHNRWDNNCD-UHFFFAOYSA-N" ],
    "mass" : [ "308.35300" ],
    "monoisotopicmass" : [ "308.08308" ],
    "smiles" : [ "Cc1c(Sc2ccccc2)n(COCCO)c(=O)[nH]c1=O" ]
  },
  "label" : "1-[(2-hydroxyethoxy)methyl]-6-(phenylsulfanyl)thymine",
  "ontology_name" : "slm",
  "ontology_prefix" : "SLM",
  "ontology_iri" : "https://swisslipids.org/rdf/SLM_",
  "is_obsolete" : false,
  "term_replaced_by" : null,
  "is_defining_ontology" : false,
  "has_children" : false,
  "is_root" : false,
  "short_form" : "CHEBI_43060",
  "obo_id" : "CHEBI:43060",
  "in_subset" : [ "3_STAR" ],
  "obo_definition_citation" : null,
  "obo_xref" : [ {
    "database" : "CAS",
    "id" : "123027-56-5",
    "description" : "ChemIDplus",
    "url" : null
  }, {
    "database" : "PDBeChem",
    "id" : "HEF",
    "description" : null,
    "url" : "https://www.ebi.ac.uk/pdbe-srv/pdbechem/chemicalCompound/show/HEF"
  }, {
    "database" : "PMID",
    "id" : "1683214",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/1683214"
  }, {
    "database" : "PMID",
    "id" : "17191775",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/17191775"
  }, {
    "database" : "PMID",
    "id" : "1992136",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/1992136"
  }, {
    "database" : "Reaxys",
    "id" : "4271052",
    "description" : "Reaxys",
    "url" : null
  } ],
  "obo_synonym" : [ {
    "name" : "1-[(2-hydroxyethoxy)methyl]-5-methyl-6-(phenylsulfanyl)pyrimidine-2,4(1H,3H)-dione",
    "scope" : "hasExactSynonym",
    "type" : "IUPAC NAME",
    "xrefs" : [ {
      "database" : null,
      "id" : "IUPAC",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "1-(2-HYDROXYETHYLOXYMETHYL)-6-PHENYL THIOTHYMINE",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "PDBeChem",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "1-[(2-hydroxyethoxy)methyl]-6-(phenylthio)thymine",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChEBI",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "1-[(2-hydroxyethoxy)methyl]-6-phenylthiothymine",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChEBI",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "6-Hept",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChemIDplus",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "HEPT",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChEBI",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "HMPTT",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChemIDplus",
      "description" : null,
      "url" : null
    } ]
  } ],
  "is_preferred_root" : false,
  "_links" : {
    "self" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/slm/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_43060?lang=en"
    },
    "parents" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/slm/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_43060/parents"
    },
    "ancestors" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/slm/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_43060/ancestors"
    },
    "hierarchicalParents" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/slm/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_43060/hierarchicalParents"
    },
    "hierarchicalAncestors" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/slm/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_43060/hierarchicalAncestors"
    },
    "jstree" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/slm/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_43060/jstree"
    },
    "graph" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/slm/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_43060/graph"
    },
    "has_functional_parent" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/slm/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_43060/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252Fchebi%2523has_functional_parent"
    },
    "has_role" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/slm/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_43060/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FRO_0000087"
    }
  }
}