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CHEBI:228508 - Vardenafil N-oxide

ChEBI IDCHEBI:228508
ChEBI NameVardenafil N-oxide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H32N6O5S
Net Charge0
Average Mass504.613
Monoisotopic Mass504.21549
SMILESCCCc1nc(C)c2c(=O)nc(-c3cc(S(=O)(=O)N4CC[N+]([O-])(CC)CC4)ccc3OCC)nn12
InChIInChI=1S/C23H32N6O5S/c1-5-8-20-24-16(4)21-23(30)25-22(26-28(20)21)18-15-17(9-10-19(18)34-7-3)35(32,33)27-11-13-29(31,6-2)14-12-27/h9-10,15H,5-8,11-14H2,1-4H3,(H,25,26,30)
InChIKeyGXUGEZIHENHAGP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
Vardenafil N-oxide (CHEBI:228508) is a sulfonamide (CHEBI:35358)
IUPAC Name 
2-[2-ethoxy-5-(4-ethyl-4-oxidopiperazin-4-ium-1-yl)sulonylphenyl]-5-methyl-7-propyl-3H-imidazo[5,1-][1,2,4]triazin-4-one
Manual XrefsDatabases
9550478ChemSpider