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CHEBI:20480 - 4-thiouridine

ChEBI IDCHEBI:20480
ChEBI Name4-thiouridine
Stars
DefinitionA thiouridine in which the oxygen replaced by sulfur is that at C-4.
Last Modified3 April 2020
DownloadsMolfile
FormulaC9H12N2O5S
Net Charge0
Average Mass260.271
Monoisotopic Mass260.04669
SMILESO=c1nc(=S)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
InChIInChI=1S/C9H12N2O5S/c12-3-4-6(13)7(14)8(16-4)11-2-1-5(17)10-9(11)15/h1-2,4,6-8,12-14H,3H2,(H,10,15,17)/t4-,6-,7-,8-/m1/s1
InChIKeyZLOIGESWDJYCTF-XVFCMESISA-N
Roles Classification
Biological Roles:
affinity label  An enzyme inhibitor, generally irreversible, that is similar in structure to a particular substrate for a specific enzyme.
antimetabolite  A substance which is structurally similar to a metabolite but which competes with it or replaces it, and so prevents or reduces its normal utilization.
ChEBI Ontology
Outgoing Relation(s)
4-thiouridine (CHEBI:20480) has role affinity label (CHEBI:60788)
4-thiouridine (CHEBI:20480) has role antimetabolite (CHEBI:35221)
4-thiouridine (CHEBI:20480) is a nucleoside analogue (CHEBI:60783)
4-thiouridine (CHEBI:20480) is a thiouridine (CHEBI:26978)
IUPAC Name 
1-(β-D-ribofuranosyl)-4-thioxo-3,4-dihydropyrimidin-2(1H)-one
Synonyms  Source
thiouridineChemIDplus
1-β-D-ribofuranosyl-4-thiouracilChEBI
s4uChEBI
UniProt Name  Source
4-thiouridineUniProt
Registry NumbersSources
Reaxys:28750Reaxys
CAS:13957-31-8ChemIDplus