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CHEBI:31398 - ciclopirox olamine

ChEBI IDCHEBI:31398
ChEBI Nameciclopirox olamine
Stars
DefinitionThe ethanolamine salt of ciclopirox. A broad spectrum antigfungal agent, it also exhibits antibacterial activity against many Gram-positive and Gram-negative bacteria, and has anti-inflammatory properties. It is used a a topical treatment of fungal skin and nail infections.
Secondary ChEBI IDsCHEBI:489955, CHEBI:566263
Last Modified20 September 2021
DownloadsMolfile
FormulaC12H16NO2.C2H8NO
Net Charge0
Average Mass268.357
Monoisotopic Mass268.17869
SMILESCc1cc(C2CCCCC2)n([O-])c(=O)c1.[NH3+]CCO
InChIInChI=1S/C12H16NO2.C2H7NO/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10;3-1-2-4/h7-8,10H,2-6H2,1H3;4H,1-3H2/q-1;/p+1
InChIKeyHKUKJIQHPXYJTP-UHFFFAOYSA-O
Roles Classification
Biological Roles:
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
ferroptosis inhibitor  Any substance that inhibits the process of ferroptosis (a type of programmed cell death dependent on iron and characterized by the accumulation of lipid peroxides) in organisms.
antifungal drug  Any antifungal agent used to prevent or treat fungal infections in humans or animals.
Applications:
geroprotector  Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
antiseborrheic  A drug or agent applied to the skin to control seborrhea or seborrheic dermatitis.
antifungal drug  Any antifungal agent used to prevent or treat fungal infections in humans or animals.
ChEBI Ontology
Outgoing Relation(s)
ciclopirox olamine (CHEBI:31398) has part ciclopirox (CHEBI:453011)
ciclopirox olamine (CHEBI:31398) has part ethanolaminium(1+) (CHEBI:57603)
ciclopirox olamine (CHEBI:31398) has role antibacterial agent (CHEBI:33282)
ciclopirox olamine (CHEBI:31398) has role antiseborrheic (CHEBI:59010)
ciclopirox olamine (CHEBI:31398) has role ferroptosis inhibitor (CHEBI:173084)
ciclopirox olamine (CHEBI:31398) has role geroprotector (CHEBI:176497)
ciclopirox olamine (CHEBI:31398) is a hydroxypyridone antifungal drug (CHEBI:87130)
ciclopirox olamine (CHEBI:31398) is a organoammonium salt (CHEBI:46850)
IUPAC Name 
2-hydroxyethanaminium 6-cyclohexyl-4-methyl-2-oxopyridin-1(2H)-olate
Synonyms  Source
ciclopirox ethanolamine saltChemIDplus
HOE-296DrugBank
HOE 296ChemIDplus
Brand Names  Source
LoproxChemIDplus
MycosterChemIDplus
MicoxolaminaChemIDplus
BrumixolChemIDplus
BatrafenChemIDplus
Manual XrefsDatabases
D01364KEGG DRUG
DBSALT001147DrugBank
Registry NumbersSources
Beilstein:6494273Beilstein
CAS:41621-49-2KEGG DRUG
CAS:41621-49-2ChemIDplus
Citations