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CHEBI:132296 - pseudoephedrine(1+)

ChEBI IDCHEBI:132296
ChEBI Namepseudoephedrine(1+)
Stars
DefinitionAn organic cation obtained by protonation of the secondary amino function of pseudoephedrine.
Last Modified7 May 2020
SubmitterSteve
DownloadsMolfile
FormulaC10H16NO
Net Charge+1
Average Mass166.244
Monoisotopic Mass166.12264
SMILESC[NH2+][C@@H](C)[C@@H](O)c1ccccc1
InChIInChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/p+1/t8-,10+/m0/s1
InChIKeyKWGRBVOPPLSCSI-WCBMZHEXSA-O
ChEBI Ontology
Outgoing Relation(s)
pseudoephedrine(1+) (CHEBI:132296) is a ammonium ion derivative (CHEBI:35274)
pseudoephedrine(1+) (CHEBI:132296) is a organic cation (CHEBI:25697)
pseudoephedrine(1+) (CHEBI:132296) is conjugate acid of pseudoephedrine (CHEBI:51209)
pseudoephedrine(1+) (CHEBI:132296) is enantiomer of (1R,2R)-pseudoephedrine(1+) (CHEBI:149674)
Incoming Relation(s)
pseudoephedrine hydrochloride (CHEBI:8604) has part pseudoephedrine(1+) (CHEBI:132296)
pseudoephedrine (CHEBI:51209) is conjugate base of pseudoephedrine(1+) (CHEBI:132296)
(1R,2R)-pseudoephedrine(1+) (CHEBI:149674) is enantiomer of pseudoephedrine(1+) (CHEBI:132296)
IUPAC Name 
(1S,2S)-1-hydroxy-N-methyl-1-phenylpropan-2-aminium
Synonym  Source
pseudoephedrine cationChEBI
UniProt Name  Source
(1S,2S)-pseudoephedrineUniProt