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CHEBI:44298 - ethyl (4S)-4-(3-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

ChEBI IDCHEBI:44298
ChEBI Nameethyl (4S)-4-(3-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Stars
ASCII Nameethyl (4S)-4-(3-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Last Modified17 October 2009
DownloadsMolfile
FormulaC14H16N2O3S
Net Charge0
Average Mass292.360
Monoisotopic Mass292.08816
SMILES[H]Oc1c([H])c([H])c([H])c([C@@]2([H])C(C(=O)OC([H])([H])C([H])([H])[H])=C(C([H])([H])[H])N([H])C(=S)N2[H])c1[H]
InChIInChI=1S/C14H16N2O3S/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,12,17H,3H2,1-2H3,(H2,15,16,20)/t12-/m0/s1
InChIKeyLOBCDGHHHHGHFA-LBPRGKRZSA-N
ChEBI Ontology
Outgoing Relation(s)
ethyl (4S)-4-(3-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate (CHEBI:44298) is a pyrimidinecarboxylate ester (CHEBI:48451)
Synonyms  Source
ETHYL 4-(3-HYDROXYPHENYL)-6-METHYL-2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATEPDBeChem
ethyl (4S)-4-(3-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylatePDBeChem
Manual XrefsDatabases
NATPDBeChem