CHEBI:80754 - guvacoline

ChEBI IDCHEBI:80754
ChEBI Nameguvacoline
Stars
DefinitionThe methyl ester of guvacine.
Last Modified2 April 2015
DownloadsMolfile
FormulaC7H11NO2
Net Charge0
Average Mass141.170
Monoisotopic Mass141.07898
SMILESCOC(=O)C1=CCCNC1
InChIInChI=1S/C7H11NO2/c1-10-7(9)6-3-2-4-8-5-6/h3,8H,2,4-5H2,1H3
InChIKeyDYPLDWLIOGXSSE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Areca catechu (ncbitaxon:184783) fruit (BTO:0000486) Article (Phytochemistry, 1998, Vol. 48(3), pp. 581-582.)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
muscarinic agonist  Any drug that binds to and activates a muscarinic cholinergic receptor.
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:
muscarinic agonist  Any drug that binds to and activates a muscarinic cholinergic receptor.
ChEBI Ontology
Outgoing Relation(s)
guvacoline (CHEBI:80754) has functional parent guvacine (CHEBI:5576)
guvacoline (CHEBI:80754) has role muscarinic agonist (CHEBI:38325)
guvacoline (CHEBI:80754) has role plant metabolite (CHEBI:76924)
guvacoline (CHEBI:80754) is a enoate ester (CHEBI:51702)
guvacoline (CHEBI:80754) is a methyl ester (CHEBI:25248)
guvacoline (CHEBI:80754) is a pyridine alkaloid (CHEBI:26416)
guvacoline (CHEBI:80754) is a secondary amino compound (CHEBI:50995)
guvacoline (CHEBI:80754) is a tetrahydropyridine (CHEBI:26921)
guvacoline (CHEBI:80754) is a α,β-unsaturated carboxylic ester (CHEBI:51737)
guvacoline (CHEBI:80754) is a β-amino acid ester (CHEBI:85139)
IUPAC Name 
methyl 1,2,5,6-tetrahydropyridine-3-carboxylate
Synonyms  Source
guvacine methyl esterChEBI
guvacolineChEBI
methyl 1,2,5,6-tetrahydronicotinateChEBI
norarecolineChEBI
Manual XrefsDatabases
C00044191KNApSAcK
C16821KEGG COMPOUND
Registry NumbersSources
CAS:495-19-2KEGG COMPOUND
CAS:495-19-2ChemIDplus
Citations