CHEBI:108298 - 7-[(3-bromophenyl)methyl]-1,3-dimethyl-8-(2-methylpropylamino)purine-2,6-dione

ChEBI IDCHEBI:108298
ChEBI Name7-[(3-bromophenyl)methyl]-1,3-dimethyl-8-(2-methylpropylamino)purine-2,6-dione
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FormulaC18H22BrN5O2
Net Charge0
Average Mass420.311
Monoisotopic Mass419.09569
SMILESCC(C)CNc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1cccc(Br)c1
InChIInChI=1S/C18H22BrN5O2/c1-11(2)9-20-17-21-15-14(16(25)23(4)18(26)22(15)3)24(17)10-12-6-5-7-13(19)8-12/h5-8,11H,9-10H2,1-4H3,(H,20,21)
InChIKeyBAJAGPSKIPXFJA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7-[(3-bromophenyl)methyl]-1,3-dimethyl-8-(2-methylpropylamino)purine-2,6-dione (CHEBI:108298) is a oxopurine (CHEBI:25810)
Manual XrefsDatabases
LSM-19675LINCS