EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:123360 - 8-(2,5-dimethylphenoxy)-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione

ChEBI IDCHEBI:123360
ChEBI Name8-(2,5-dimethylphenoxy)-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione
Stars
DownloadsMolfile
FormulaC18H20N4O3
Net Charge0
Average Mass340.383
Monoisotopic Mass340.15354
SMILESC=CCn1c(Oc2cc(C)ccc2C)nc2c1c(=O)n(C)c(=O)n2C
InChIInChI=1S/C18H20N4O3/c1-6-9-22-14-15(20(4)18(24)21(5)16(14)23)19-17(22)25-13-10-11(2)7-8-12(13)3/h6-8,10H,1,9H2,2-5H3
InChIKeyJJVPINNJXFOOJE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
8-(2,5-dimethylphenoxy)-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione (CHEBI:123360) is a oxopurine (CHEBI:25810)
Manual XrefsDatabases
LSM-34802LINCS