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CHEBI:230012 - 4-Amino-1-[(2S,4S)-2-(hydroxymethyl)-1,3-oxathiolan-4-yl]pyrimidin-2-one

ChEBI IDCHEBI:230012
ChEBI Name4-Amino-1-[(2S,4S)-2-(hydroxymethyl)-1,3-oxathiolan-4-yl]pyrimidin-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H11N3O3S
Net Charge0
Average Mass229.261
Monoisotopic Mass229.05211
SMILESNc1ccn([C@@H]2CO[C@H](CO)S2)c(=O)n1
InChIInChI=1S/C8H11N3O3S/c9-5-1-2-11(8(13)10-5)6-4-14-7(3-12)15-6/h1-2,6-7,12H,3-4H2,(H2,9,10,13)/t6-,7-/m0/s1
InChIKeyRYMCFYKJDVMSIR-BQBZGAKWSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
4-Amino-1-[(2S,4S)-2-(hydroxymethyl)-1,3-oxathiolan-4-yl]pyrimidin-2-one (CHEBI:230012) is a hydroxypyrimidine (CHEBI:38340)
IUPAC Name 
4-amino-1-[(2S,4S)-2-(hydroxymethyl)-1,3-oxathiolan-4-yl]pyrimidin-2-one
Manual XrefsDatabases
411358ChemSpider