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CHEBI:169165 - meta-O-Dealkylated flecainide

Default Structure
ChEBI IDCHEBI:169165
ChEBI Namemeta-O-Dealkylated flecainide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H19F3N2O3
Net Charge0
Average Mass332.322
Monoisotopic Mass332.13478
SMILESO=C(NCC1CCCCN1)c1cc(O)ccc1OCC(F)(F)F
InChIInChI=1S/C15H19F3N2O3/c16-15(17,18)9-23-13-5-4-11(21)7-12(13)14(22)20-8-10-3-1-2-6-19-10/h4-5,7,10,19,21H,1-3,6,8-9H2,(H,20,22)
InChIKeyFVJPPEWHZCSTAC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
meta-O-Dealkylated flecainide (CHEBI:169165) is a benzamides (CHEBI:22702)
IUPAC Name 
5-hydroxy-N-(piperidin-2-ylmethyl)-2-(2,2,2-triluoroethoxy)benzamide
Manual XrefsDatabases
118388ChemSpider
HMDB0060831HMDB
Registry NumbersSources
CAS:83526-33-4ChemIDplus