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CHEBI:92848 - 4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)benzenesulfonic acid

ChEBI IDCHEBI:92848
ChEBI Name4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)benzenesulfonic acid
Stars
DownloadsMolfile
FormulaC14H14N4O5S
Net Charge0
Average Mass350.356
Monoisotopic Mass350.06849
SMILESCCCn1c(=O)nc2nc(-c3ccc(S(=O)(=O)O)cc3)nc2c1=O
InChIInChI=1S/C14H14N4O5S/c1-2-7-18-13(19)10-12(17-14(18)20)16-11(15-10)8-3-5-9(6-4-8)24(21,22)23/h3-6H,2,7H2,1H3,(H,15,16)(H,17,20)(H,21,22,23)
InChIKeyUYDRRQPGDSIMNU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)benzenesulfonic acid (CHEBI:92848) is a oxopurine (CHEBI:25810)
Manual XrefsDatabases
LSM-3075LINCS