CHEBI:230065 - Modecainide

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Modecainide
ChEBI ID CHEBI:230065
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H28N2O3
Net Charge 0
Average Mass 368.477
Monoisotopic Mass 368.20999
InChI InChI=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)
InChIKey LBYXPDAENJSHDD-UHFFFAOYSA-N
SMILES O=C(NC=1C(CCC2N(CCCC2)C)=CC=CC1)C3=CC(OC)=C(O)C=C3
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xrefs Databases
49444 ChemSpider
D05065 KEGG DRUG
HMDB0254822 HMDB
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