CHEBI:51209 - pseudoephedrine

ChEBI IDCHEBI:51209
ChEBI Namepseudoephedrine
Stars
DefinitionA member of the class of the class of phenylethanolamines that is (1S)-2-(methylamino)-1-phenylethan-1-ol in which the pro-S hydrogen at position 2 is replaced by a methyl group.
Secondary ChEBI IDCHEBI:44
Last Modified2 February 2018
SubmitterInma Spiteri
DownloadsMolfile
FormulaC10H15NO
Net Charge0
Average Mass165.236
Monoisotopic Mass165.11536
SMILESCN[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/t8-,10+/m0/s1
InChIKeyKWGRBVOPPLSCSI-WCBMZHEXSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
sympathomimetic agent  A drug that mimics the effects of stimulating postganglionic adrenergic sympathetic nerves. Included in this class are drugs that directly stimulate adrenergic receptors and drugs that act indirectly by provoking the release of adrenergic transmitters.
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Applications:
nasal decongestant  A drug used to relieve nasal congestion in the upper respiratory tract.
sympathomimetic agent  A drug that mimics the effects of stimulating postganglionic adrenergic sympathetic nerves. Included in this class are drugs that directly stimulate adrenergic receptors and drugs that act indirectly by provoking the release of adrenergic transmitters.
anti-asthmatic drug  A drug used to treat asthma.
vasoconstrictor agent  Drug used to cause constriction of the blood vessels.
bronchodilator agent  An agent that causes an increase in the expansion of a bronchus or bronchial tubes.
central nervous system drug  A class of drugs producing both physiological and psychological effects through a variety of mechanisms involving the central nervous system.
ChEBI Ontology
Outgoing Relation(s)
pseudoephedrine (CHEBI:51209) has role anti-asthmatic drug (CHEBI:49167)
pseudoephedrine (CHEBI:51209) has role bronchodilator agent (CHEBI:35523)
pseudoephedrine (CHEBI:51209) has role central nervous system drug (CHEBI:35470)
pseudoephedrine (CHEBI:51209) has role nasal decongestant (CHEBI:77715)
pseudoephedrine (CHEBI:51209) has role plant metabolite (CHEBI:76924)
pseudoephedrine (CHEBI:51209) has role sympathomimetic agent (CHEBI:35524)
pseudoephedrine (CHEBI:51209) has role vasoconstrictor agent (CHEBI:50514)
pseudoephedrine (CHEBI:51209) has role xenobiotic (CHEBI:35703)
pseudoephedrine (CHEBI:51209) is a phenylethanolamines (CHEBI:25990)
pseudoephedrine (CHEBI:51209) is a secondary alcohol (CHEBI:35681)
pseudoephedrine (CHEBI:51209) is a secondary amino compound (CHEBI:50995)
pseudoephedrine (CHEBI:51209) is conjugate base of pseudoephedrine(1+) (CHEBI:132296)
Incoming Relation(s)
pseudoephedrine(1+) (CHEBI:132296) is conjugate acid of pseudoephedrine (CHEBI:51209)
IUPAC Name 
(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol
INNs  Source
pseudoephedrineWHO MedNet
pseudoéphédrineWHO MedNet
pseudoefedrinaWHO MedNet
pseudoephedrinumWHO MedNet
Synonyms  Source
(+)-(1S,2S)-PseudoephedrineChemIDplus
(+)-PseudoephedrineChemIDplus
(+)-psi-EphedrineChemIDplus
(+)-threo-EphedrineChemIDplus
IsoephedrineChemIDplus
L(+)-psi-EphedrineChemIDplus
Manual XrefsDatabases
C02765KEGG COMPOUND
DB00852DrugBank
PseudoephedrineWikipedia
D08449KEGG DRUG
HMDB0001943HMDB
LSM-3885LINCS
C00031097KNApSAcK
CPD-9954MetaCyc
2326DrugCentral
Registry NumbersSources
Reaxys:2414132Reaxys
CAS:90-82-4KEGG COMPOUND
CAS:90-82-4ChemIDplus
CAS:90-82-4NIST Chemistry WebBook
Citations