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CHEBI:8604 - pseudoephedrine hydrochloride

ChEBI IDCHEBI:8604
ChEBI Namepseudoephedrine hydrochloride
Stars
DefinitionA hydrochloride that is the monohydrochloride salt of pseudoephedrine.
Last Modified27 June 2016
DownloadsMolfile
FormulaH.C10H15NO.Cl
Net Charge0
Average Mass201.697
Monoisotopic Mass201.09204
SMILESCN[C@@H](C)[C@@H](O)c1ccccc1.[Cl-].[H+]
InChIInChI=1S/C10H15NO.ClH/c1-8(11-2)10(12)9-6-4-3-5-7-9;/h3-8,10-12H,1-2H3;1H/t8-,10+;/m0./s1
InChIKeyBALXUFOVQVENIU-KXNXZCPBSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
pseudoephedrine hydrochloride (CHEBI:8604) has part pseudoephedrine(1+) (CHEBI:132296)
pseudoephedrine hydrochloride (CHEBI:8604) has role plant metabolite (CHEBI:76924)
pseudoephedrine hydrochloride (CHEBI:8604) is a hydrochloride (CHEBI:36807)
IUPAC Name 
(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol hydrochloride
Synonyms  Source
(+)-Pseudoephedrine hydrochlorideChemIDplus
D-Pseudoephedrine hydrochlorideChemIDplus
L(+)-Pseudoephedrine hydrochlorideChemIDplus
d-(alpha-(1-Methylamino)ethyl)benzyl alcohol hydrochlorideChemIDplus
d-Pseudoephedrine hydrochlorideChemIDplus
Manual XrefsDatabases
D00485KEGG DRUG
DB00852DrugBank
Registry NumbersSources
Beilstein:3915112Beilstein
CAS:345-78-8ChemIDplus