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ChEBI
> Main
CHEBI:59008 - piroctone olamine
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ChEBI Name
piroctone olamine
ChEBI ID
CHEBI:59008
Definition
An organoammonium salt that is the ethanolamine salt of piroctone.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formulae
C14H23NO2.C2H7NO
C16H30N2O3
Net Charge
0
Average Mass
298.42100
Monoisotopic Mass
298.22564
InChI
InChI=1S/C14H22NO2.C2H7NO/c1-
10-
6-
12(15(17)
13(16)
8-
10)
7-
11(2)
9-
14(3,4)
5;3-
1-
2-
4/h6,8,11H,7,9H2,1-
5H3;4H,1-
3H2/q-
1;/p+1
InChIKey
GHPFVSRTGHIHCD-UHFFFAOYSA-O
SMILES
[NH3+]CCO.CC(Cc1cc(C)cc(=O)n1[O-])CC(C)(C)C
Roles Classification
Biological Role
(s):
drug allergen
Any drug which causes the onset of an allergic reaction.
antifungal drug
Any antifungal agent used to prevent or treat fungal infections in humans or animals.
(via
hydroxypyridone antifungal drug
)
Application
(s):
drug allergen
Any drug which causes the onset of an allergic reaction.
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.
(via
hydroxypyridone antifungal drug
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
piroctone olamine (
CHEBI:59008
)
has part
ethanolaminium(1+) (
CHEBI:57603
)
piroctone olamine (
CHEBI:59008
)
has part
piroctone (
CHEBI:59009
)
piroctone olamine (
CHEBI:59008
)
has role
antiseborrheic (
CHEBI:59010
)
piroctone olamine (
CHEBI:59008
)
has role
drug allergen (
CHEBI:88188
)
piroctone olamine (
CHEBI:59008
)
is a
hydroxypyridone antifungal drug (
CHEBI:87130
)
piroctone olamine (
CHEBI:59008
)
is a
organoammonium salt (
CHEBI:46850
)
IUPAC Name
2-hydroxyethanaminium 4-methyl-2-oxo-6-(2,4,4-trimethylpentyl)pyridin-1(2
H
)-olate
Synonyms
Sources
1-Hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)-2-(1H)pyridinone 2-aminoethanol salt
ChemIDplus
Piroctone ethanolamine salt
ChemIDplus
Manual Xrefs
Databases
D05505
KEGG DRUG
Piroctone_olamine
Wikipedia
View more database links
Registry Numbers
Types
Sources
68890-66-4
CAS Registry Number
KEGG DRUG
68890-66-4
CAS Registry Number
ChemIDplus
7503297
Beilstein Registry Number
Beilstein
7503297
Reaxys Registry Number
Reaxys
Citation
Type
Source
18837732
PubMed citation
Europe PMC
Last Modified
12 March 2019