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CHEBI:230065 - Modecainide

ChEBI IDCHEBI:230065
ChEBI NameModecainide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H28N2O3
Net Charge0
Average Mass368.477
Monoisotopic Mass368.20999
SMILESCOc1cc(C(=O)Nc2ccccc2CCC2CCCCN2C)ccc1O
InChIInChI=1S/C22H28N2O3/c1-24-14-6-5-8-18(24)12-10-16-7-3-4-9-19(16)23-22(26)17-11-13-20(25)21(15-17)27-2/h3-4,7,9,11,13,15,18,25H,5-6,8,10,12,14H2,1-2H3,(H,23,26)
InChIKeyLBYXPDAENJSHDD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
Modecainide (CHEBI:230065) is a methoxybenzenes (CHEBI:51683)
Modecainide (CHEBI:230065) is a phenols (CHEBI:33853)
IUPAC Name 
4-hydroxy-3-methoxy-N-[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl]benzamide
Manual XrefsDatabases
D05065KEGG DRUG
49444ChemSpider
HMDB0254822HMDB