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CHEBI:85324 - 7-{2-hydroxy-3-[(naphthalen-1-yl)oxy]propyl}-3-methyl-8-(morpholin-4-yl)-3,7-dihydropurine-2,6-dione

ChEBI IDCHEBI:85324
ChEBI Name7-{2-hydroxy-3-[(naphthalen-1-yl)oxy]propyl}-3-methyl-8-(morpholin-4-yl)-3,7-dihydropurine-2,6-dione
Stars
DefinitionA member of the class of oxopurines that is 3-methyl-8-(morpholin-4-yl)-3,7-dihydropurine-2,6-dione bearing an additional 2-hydroxy-3-[(naphthalen-1-yl)oxy]propyl substituent at position 7.
Last Modified16 April 2015
Submitterchristian_grove
DownloadsMolfile
FormulaC23H25N5O5
Net Charge0
Average Mass451.483
Monoisotopic Mass451.18557
SMILESCn1c(=O)nc(=O)c2c1nc(N1CCOCC1)n2CC(O)COc1cccc2ccccc12
InChIInChI=1S/C23H25N5O5/c1-26-20-19(21(30)25-23(26)31)28(22(24-20)27-9-11-32-12-10-27)13-16(29)14-33-18-8-4-6-15-5-2-3-7-17(15)18/h2-8,16,29H,9-14H2,1H3,(H,25,30,31)
InChIKeyXONRWRMHSNYXSM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7-{2-hydroxy-3-[(naphthalen-1-yl)oxy]propyl}-3-methyl-8-(morpholin-4-yl)-3,7-dihydropurine-2,6-dione (CHEBI:85324) is a alkyloxynaphthalene (CHEBI:48850)
7-{2-hydroxy-3-[(naphthalen-1-yl)oxy]propyl}-3-methyl-8-(morpholin-4-yl)-3,7-dihydropurine-2,6-dione (CHEBI:85324) is a morpholines (CHEBI:38785)
7-{2-hydroxy-3-[(naphthalen-1-yl)oxy]propyl}-3-methyl-8-(morpholin-4-yl)-3,7-dihydropurine-2,6-dione (CHEBI:85324) is a oxopurine (CHEBI:25810)
7-{2-hydroxy-3-[(naphthalen-1-yl)oxy]propyl}-3-methyl-8-(morpholin-4-yl)-3,7-dihydropurine-2,6-dione (CHEBI:85324) is a secondary alcohol (CHEBI:35681)
IUPAC Name 
7-{2-hydroxy-3-[(naphthalen-1-yl)oxy]propyl}-3-methyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Synonyms  Source
AC1MWOZXSUBMITTER
Oprea1_405335SUBMITTER
MolPort-000-822-839SUBMITTER
MolPort-002-537-342SUBMITTER
STK073890SUBMITTER
Registry NumbersSources
Reaxys:26434556Reaxys
Citations