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CHEBI:123290 - 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid methyl ester

ChEBI IDCHEBI:123290
ChEBI Name3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid methyl ester
Stars
Last Modified7 April 2016
DownloadsMolfile
FormulaC9H12N2O3S
Net Charge0
Average Mass228.273
Monoisotopic Mass228.05686
SMILESCOC(=O)CCc1c(C)nc(=S)nc1=O
InChIInChI=1S/C9H12N2O3S/c1-5-6(3-4-7(12)14-2)8(13)11-9(15)10-5/h3-4H2,1-2H3,(H2,10,11,13,15)
InChIKeyISRRLTIEWOHRNX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid methyl ester (CHEBI:123290) is a methyl ester (CHEBI:25248)
3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid methyl ester (CHEBI:123290) is a pyrimidinethione (CHEBI:48546)
3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid methyl ester (CHEBI:123290) is a pyrimidone (CHEBI:38337)
Manual XrefsDatabases
LSM-34732LINCS