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CHEBI:149674 - (1R,2R)-pseudoephedrine(1+)

ChEBI IDCHEBI:149674
ChEBI Name(1R,2R)-pseudoephedrine(1+)
Stars
ASCII Name(1R,2R)-pseudoephedrine(1+)
DefinitionAn organic cation obtained by protonation of the secondary amino function of (1R,2R)-pseudoephedrine; major species at pH 7.3.
SubmitterAnne Morgat
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+/m1/s1
InChIKeyKWGRBVOPPLSCSI-SCZZXKLOSA-O
ChEBI Ontology
Outgoing Relation(s)
(1R,2R)-pseudoephedrine(1+) (CHEBI:149674) is a ammonium ion derivative (CHEBI:35274)
(1R,2R)-pseudoephedrine(1+) (CHEBI:149674) is enantiomer of pseudoephedrine(1+) (CHEBI:132296)
Incoming Relation(s)
pseudoephedrine(1+) (CHEBI:132296) is enantiomer of (1R,2R)-pseudoephedrine(1+) (CHEBI:149674)
UniProt Name  Source
(1R,2R)-pseudoephedrineUniProt
Manual XrefsDatabases
CPD-22732MetaCyc