CHEBI:8021 - pergolide mesylate

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ChEBI Name pergolide mesylate
ChEBI ID CHEBI:8021
Definition A methanesulfonate salt obtained from pergolide by mixing eqimolar amount of pergolide and methanesulfonic acid. A dopamine D2 receptor agonist which also has D1 and D2 agonist properties, it is used in the management of Parkinson's disease, although it was withdrawn from the U.S. and Canadian markets in 2007 due to an increased risk of cardiac valve dysfunction.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C20H30N2O3S2
Net Charge 0
Average Mass 410.59400
Monoisotopic Mass 410.16979
InChI InChI=1S/C19H26N2S.CH4O3S/c1-3-7-21-11-13(12-22-2)8-16-15-5-4-6-17-19(15)14(10-20-17)9-18(16)21;1-5(2,3)4/h4-6,10,13,16,18,20H,3,7-9,11-12H2,1-2H3;1H3,(H,2,3,4)/t13-,16-,18-;/m1./s1
InChIKey UWCVGPLTGZWHGS-ZORIOUSZSA-N
SMILES CS(O)(=O)=O.[H][C@@]12Cc3c[nH]c4cccc(c34)[C@@]1([H])C[C@@H](CSC)CN2CCC
Roles Classification
Biological Role(s): dopamine agonist
A drug that binds to and activates dopamine receptors.
Application(s): antiparkinson drug
A drug used in the treatment of Parkinson's disease.
dopamine agonist
A drug that binds to and activates dopamine receptors.
geroprotector
Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pergolide mesylate (CHEBI:8021) has part pergolide(1+) (CHEBI:63706)
pergolide mesylate (CHEBI:8021) has role antiparkinson drug (CHEBI:48407)
pergolide mesylate (CHEBI:8021) has role dopamine agonist (CHEBI:51065)
pergolide mesylate (CHEBI:8021) has role geroprotector (CHEBI:176497)
pergolide mesylate (CHEBI:8021) is a methanesulfonate salt (CHEBI:38037)
IUPAC Name
(8β)-8-[(methylsulfanyl)methyl]-6-propylergoline methanesulfonate
Synonyms Sources
(8β)-8-[(methylsulfanyl)methyl]-6-propylergolin-6-ium methanesulfonate IUPAC
Pergolide mesilate KEGG DRUG
pergolide methanesulfonate ChEBI
pergolide monomesylate ChEBI
pergolide monomethanesulfonate ChEBI
Brand Name Source
Permax KEGG DRUG
Manual Xrefs Databases
43504 ChemSpider
D00502 KEGG DRUG
DBSALT002445 DrugBank
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Registry Numbers Types Sources
5698117 Reaxys Registry Number Reaxys
66104-23-2 CAS Registry Number KEGG DRUG
66104-23-2 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
27 October 2021