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CHEBI:45910 - 6-benzyl-1-(benzyloxymethyl)-5-isopropyluracil

ChEBI IDCHEBI:45910
ChEBI Name6-benzyl-1-(benzyloxymethyl)-5-isopropyluracil
Stars
DefinitionA pyrimidone that is uracil which is substituted at positions 1, 5, and 6 by benzyloxymethyl, isopropyl, and benzyl groups, respectively.
Last Modified1 August 2011
DownloadsMolfile
FormulaC22H24N2O3
Net Charge0
Average Mass364.445
Monoisotopic Mass364.17869
SMILESCC(C)c1c(Cc2ccccc2)n(COCc2ccccc2)c(=O)nc1=O
InChIInChI=1S/C22H24N2O3/c1-16(2)20-19(13-17-9-5-3-6-10-17)24(22(26)23-21(20)25)15-27-14-18-11-7-4-8-12-18/h3-12,16H,13-15H2,1-2H3,(H,23,25,26)
InChIKeyKSAAUHMSLCPIEX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-benzyl-1-(benzyloxymethyl)-5-isopropyluracil (CHEBI:45910) has functional parent uracil (CHEBI:17568)
6-benzyl-1-(benzyloxymethyl)-5-isopropyluracil (CHEBI:45910) is a pyrimidone (CHEBI:38337)
IUPAC Name 
6-benzyl-1-[(benzyloxy)methyl]-5-(propan-2-yl)pyrimidine-2,4(1H,3H)-dione
Synonyms  Source
5-(1-methylethyl)-1-[(phenylmethoxy)methyl]-6-(phenylmethyl)-2,4(1H,3H)-pyrimidinedioneChEBI
6-benzyl-1-[(benzyloxy)methyl]-5-(1-methylethyl)uracilChEBI
6-BENZYL-1-BENZYLOXYMETHYL-5-ISOPROPYL URACILPDBeChem
TNK-651ChemIDplus
TNK651ChemIDplus
Manual XrefsDatabases
TNKPDBeChem
Registry NumbersSources
Reaxys:7496442Reaxys
CAS:175739-42-1ChemIDplus