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CHEBI:86993 - (R)-fluoxetine(1+)

ChEBI IDCHEBI:86993
ChEBI Name(R)-fluoxetine(1+)
Stars
ASCII Name(R)-fluoxetine(1+)
DefinitionAn organic cation resulting from the protonation of the amino group of (R)-fluoxetine.
Last Modified20 July 2015
SubmitterGareth Owen
DownloadsMolfile
FormulaC17H19F3NO
Net Charge+1
Average Mass310.339
Monoisotopic Mass310.14133
SMILESC[NH2+]CC[C@@H](Oc1ccc(C(F)(F)F)cc1)c1ccccc1
InChIInChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3/p+1/t16-/m1/s1
InChIKeyRTHCYVBBDHJXIQ-MRXNPFEDSA-O
ChEBI Ontology
Outgoing Relation(s)
(R)-fluoxetine(1+) (CHEBI:86993) is a ammonium ion derivative (CHEBI:35274)
(R)-fluoxetine(1+) (CHEBI:86993) is a organic cation (CHEBI:25697)
(R)-fluoxetine(1+) (CHEBI:86993) is conjugate acid of (R)-fluoxetine (CHEBI:86991)
(R)-fluoxetine(1+) (CHEBI:86993) is enantiomer of (S)-fluoxetine(1+) (CHEBI:86995)
Incoming Relation(s)
(R)-fluoxetine hydrochloride (CHEBI:86996) has part (R)-fluoxetine(1+) (CHEBI:86993)
(R)-fluoxetine (CHEBI:86991) is conjugate base of (R)-fluoxetine(1+) (CHEBI:86993)
(S)-fluoxetine(1+) (CHEBI:86995) is enantiomer of (R)-fluoxetine(1+) (CHEBI:86993)
IUPAC Name 
(3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-aminium
Synonym  Source
(+)-fluoxetine(1+)ChEBI
Registry NumbersSources
Reaxys:25263171Reaxys