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CHEBI:80605 - Citalopram propionic acid

ChEBI IDCHEBI:80605
ChEBI NameCitalopram propionic acid
Stars
DownloadsMolfile
FormulaC18H14FNO3
Net Charge0
Average Mass311.312
Monoisotopic Mass311.09577
SMILESN#Cc1ccc2c(c1)COC2(CCC(=O)O)c1ccc(F)cc1
InChIInChI=1S/C18H14FNO3/c19-15-4-2-14(3-5-15)18(8-7-17(21)22)16-6-1-12(10-20)9-13(16)11-23-18/h1-6,9H,7-8,11H2,(H,21,22)
InChIKeyJSYNRZJODZWUKX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Citalopram propionic acid (CHEBI:80605) is a benzenes (CHEBI:22712)
Citalopram propionic acid (CHEBI:80605) is a nitrile (CHEBI:18379)
Manual XrefsDatabases
C16610KEGG COMPOUND
HMDB0060463HMDB