CHEBI:29081 - synephrine

ChEBI IDCHEBI:29081
ChEBI Namesynephrine
Stars
DefinitionA phenethylamine alkaloid that is 4-(2-aminoethyl)phenol substituted by a hydroxy group at position 1 and a methyl group at the amino nitrogen.
Secondary ChEBI IDsCHEBI:570, CHEBI:11190, CHEBI:18964
Last Modified22 February 2017
DownloadsMolfile
FormulaC9H13NO2
Net Charge0
Average Mass167.208
Monoisotopic Mass167.09463
SMILESCNCC(O)c1ccc(O)cc1
InChIInChI=1S/C9H13NO2/c1-10-6-9(12)7-2-4-8(11)5-3-7/h2-5,9-12H,6H2,1H3
InChIKeyYRCWQPVGYLYSOX-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
alpha-adrenergic agonist  An agent that selectively binds to and activates α-adrenergic receptors.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application:
alpha-adrenergic agonist  An agent that selectively binds to and activates α-adrenergic receptors.
ChEBI Ontology
Outgoing Relation(s)
synephrine (CHEBI:29081) has role plant metabolite (CHEBI:76924)
synephrine (CHEBI:29081) has role α-adrenergic agonist (CHEBI:35569)
synephrine (CHEBI:29081) is a ethanolamines (CHEBI:23981)
synephrine (CHEBI:29081) is a phenethylamine alkaloid (CHEBI:38605)
synephrine (CHEBI:29081) is a phenols (CHEBI:33853)
synephrine (CHEBI:29081) is conjugate base of synephrinium (CHEBI:58606)
Incoming Relation(s)
D-synephrine (CHEBI:119) is a synephrine (CHEBI:29081)
L-synephrine (CHEBI:33016) is a synephrine (CHEBI:29081)
synephrinium (CHEBI:58606) is conjugate acid of synephrine (CHEBI:29081)
IUPAC Name 
1-(4-hydroxyphenyl)-2-(methylamino)ethanol
Synonyms  Source
1-(4-hydroxyphenyl)-2-methylaminoethanolChemIDplus
1-(4-Hydroxyphenyl)-2-(methylamino)ethanolKEGG COMPOUND
1-(4-Hydroxyphenyl)-2-(methylamino)ethanolKEGG COMPOUND
4-hydroxy-α-[(methylamino)methyl]benzenemethanolChemIDplus
p-hydroxy-α-[(methylamino)methyl]benzyl alcoholChemIDplus
OxedrineChemIDplus
Manual XrefsDatabases
3577DrugCentral
C04548KEGG COMPOUND
D07148KEGG DRUG
LSM-4956LINCS
SynephrineWikipedia
Registry NumbersSources
Beilstein:1103010Beilstein
CAS:94-07-5ChemIDplus
CAS:94-07-5KEGG COMPOUND
Citations