<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">4387</id>
  <title>T3D4333</title>
  <common-name>Dihydrouracil</common-name>
  <description>Dihydrouracil is an intermediate breakdown product of uracil. Dihydropyrimidine dehydrogenase catalyzes the reduction of uracil to 5, 6-dihydrouracil then dihydropyrimidinase hydrolyzes 5, 6-dihydrouracil to N-carbamyl-b-alanine. Finally, beta-ureidopropionase catalyzes the conversion of N-carbamyl-b-alanine to beta-alanine. Patients with dihydropyrimidinase deficiency (DPYS; also called 5, 6-dihydropyrimidine amidohydrolase, or DHP; EC 3.5.2.2) exhibit highly increased concentrations of 5, 6-dihydrouracil in urine. The direct measurement of the activity of DHP in patients had been hampered by the fact that the enzyme is expressed almost exclusively in liver tissue. Various neurological abnormalities have been described in this group of patients. (OMIM 222748).</description>
  <cas>504-07-4</cas>
  <pubchem-id>649</pubchem-id>
  <chemical-formula>C4H6N2O2</chemical-formula>
  <weight nil="true"/>
  <appearance>White powder.</appearance>
  <melting-point>279 - 281°C</melting-point>
  <boiling-point></boiling-point>
  <density nil="true"/>
  <solubility></solubility>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity>No indication of carcinogenicity to humans (not listed by IARC).</carcinogenicity>
  <use-source>This is an endogenously produced metabolite found in the human body. It is used in metabolic reactions, catabolic reactions or waste generation.</use-source>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2014-08-29T06:28:48Z</created-at>
  <updated-at type="dateTime">2026-05-14T17:18:14Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id>C00429</kegg-compound-id>
  <omim-id nil="true"/>
  <chebi-id>15901</chebi-id>
  <biocyc-id>DI-H-URACIL</biocyc-id>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id>DB01849</drugbank-id>
  <pdb-id>DUC</pdb-id>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>O=C1CCNC(=O)N1</moldb-smiles>
  <moldb-formula>C4H6N2O2</moldb-formula>
  <moldb-inchi>InChI=1S/C4H6N2O2/c7-3-1-2-5-4(8)6-3/h1-2H2,(H2,5,6,7,8)</moldb-inchi>
  <moldb-inchikey>OIVLITBTBDPEFK-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">114.1026</moldb-average-mass>
  <moldb-mono-mass type="decimal">114.042927446</moldb-mono-mass>
  <origin>Endogenous</origin>
  <state>Solid</state>
  <logp>-1.2</logp>
  <hmdb-id>HMDB00076</hmdb-id>
  <chembl-id nil="true"/>
  <chemspider-id>629</chemspider-id>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference></synthesis-reference>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM003293</chemdb-id>
  <dsstox-id>DTXSID7060122</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>1,3-diazinane-2,4-dione</iupac>
  <moldb-polar-surface-area>58.2</moldb-polar-surface-area>
  <moldb-refractivity>25.745500000000003</moldb-refractivity>
  <moldb-polarizability>10.133629968746801</moldb-polarizability>
  <moldb-rotatable-bond-count>0</moldb-rotatable-bond-count>
  <moldb-acceptor-count>2</moldb-acceptor-count>
  <moldb-donor-count>2</moldb-donor-count>
  <moldb-pka-strongest-acidic>11.726846896036472</moldb-pka-strongest-acidic>
  <moldb-pka-strongest-basic>-7.628772459765097</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>1</moldb-number-of-rings>
  <moldb-alogps-logp>-1.28</moldb-alogps-logp>
  <moldb-alogps-logs>-0.64</moldb-alogps-logs>
  <moldb-alogps-solubility>2.59e+01 g/l</moldb-alogps-solubility>
</compound>
