CHEBI:51209 - pseudoephedrine

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ChEBI Name pseudoephedrine
ChEBI ID CHEBI:51209
Definition A 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.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:44
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Formula C10H15NO
Net Charge 0
Average Mass 165.23224
Monoisotopic Mass 165.115
InChI InChI=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
InChIKey KWGRBVOPPLSCSI-WCBMZHEXSA-N
SMILES CN[C@@H](C)[C@@H](O)c1ccccc1
Roles Classification
Biological Role(s): 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.
Application(s): 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.
bronchodilator agent
An agent that causes an increase in the expansion of a bronchus or bronchial tubes.
vasoconstrictor agent
Drug used to cause constriction of the blood vessels.
central nervous system drug
A class of drugs producing both physiological and psychological effects through a variety of mechanisms involving the central nervous system.
nasal decongestant
A drug used to relieve nasal congestion in the upper respiratory tract.
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ChEBI Ontology
Outgoing 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 pseudoephedrine(1+) (CHEBI:132296) is conjugate acid of pseudoephedrine (CHEBI:51209)
IUPAC Name
(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol
INNs Sources
pseudoefedrina WHO MedNet
pseudoéphédrine WHO MedNet
pseudoephedrine WHO MedNet
pseudoephedrinum WHO MedNet
Synonyms Sources
(+) threo-2-(methylamino)-1-phenyl-1-propanol NIST Chemistry WebBook
(+)-(1S,2S)-Pseudoephedrine ChemIDplus
(+)-Pseudoephedrine ChemIDplus
(+)-psi-Ephedrine ChemIDplus
(+)-threo-Ephedrine ChemIDplus
(1S,2S)-(+)-Pseudoephedrine HMDB
(1S,2S)-Pseudoephedrine HMDB
2-(Methylamino)-1-phenyl-1-propanol HMDB
d-Isoephedrine ChemIDplus
d-Pseudoephedrine ChemIDplus
d-psi-2-Methylamino-1-phenyl-1-propanol ChemIDplus
d-psi-Ephedrine ChemIDplus
Isoephedrine ChemIDplus
L(+)-psi-Ephedrine ChemIDplus
L-(+)-Pseudoephedrine ChemIDplus
Pseudoephedrine KEGG COMPOUND
Pseudoephedrine D-form HMDB
Psi-ephedrin ChemIDplus
Psi-ephedrine ChemIDplus
ψ-ephedrine NIST Chemistry WebBook
trans-Ephedrine ChemIDplus
Database Links Databases
2326 DrugCentral
C00031097 KNApSAcK
C02765 KEGG COMPOUND
CPD-9954 MetaCyc
D08449 KEGG DRUG
DB00852 DrugBank
HMDB0001943 HMDB
LSM-1633 LINCS
Pseudoephedrine Wikipedia
View more database links
Registry Numbers Types Sources
2414132 Reaxys Registry Number Reaxys
2414132 Beilstein Registry Number Beilstein
90-82-4 CAS Registry Number KEGG COMPOUND
90-82-4 CAS Registry Number NIST Chemistry WebBook
90-82-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
11153535 PubMed citation Europe PMC
12199969 PubMed citation Europe PMC
15532139 PubMed citation Europe PMC
16410207 PubMed citation Europe PMC
16531903 PubMed citation Europe PMC
16965375 PubMed citation Europe PMC
17230461 PubMed citation Europe PMC
17316256 PubMed citation Europe PMC
26708626 PubMed citation Europe PMC
26762956 PubMed citation Europe PMC
26888635 PubMed citation Europe PMC
27168748 PubMed citation Europe PMC
27179610 PubMed citation Europe PMC
Last Modified
22 February 2017