EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:176434 - Jenamidine C

ChEBI IDCHEBI:176434
ChEBI NameJenamidine C
Stars
Submittermwilliams
DownloadsMolfile
FormulaC13H18N2O4
Net Charge0
Average Mass266.297
Monoisotopic Mass266.12666
SMILESCC/C=C(\CO)C1=CC(=O)N2CCCC(=O)C2(O)N1
InChIInChI=1S/C13H18N2O4/c1-2-4-9(8-16)10-7-12(18)15-6-3-5-11(17)13(15,19)14-10/h4,7,14,16,19H,2-3,5-6,8H2,1H3/b9-4+
InChIKeyXOAODDHGVAGGBK-RUDMXATFSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:960) urine (BTO:0001419) MetaboLights (MTBLS2295)
ChEBI Ontology
Outgoing Relation(s)
Jenamidine C (CHEBI:176434) is a pyridopyrimidine (CHEBI:38932)