piroctone olamine

CHEBI:59008 ·resolve ·ANTIFUNGAL ·EXACT SEEDED

An organoammonium salt that is the ethanolamine salt of piroctone. — ChEBI

Machine-generated and unreviewed. Identity, structure and cross-references come straight from ChEBI's and CARD's own data; no curator has signed off on this record yet.

Classification

Strictly broader compounds or drug classes this molecule belongs to.

CHEBI:46850 CHEBI:46850
CHEBI:87130 CHEBI:87130

Chemical structure

Computed structure properties
Molecular formula	C14H22NO2.C2H8NO
Charge	0
Average mass	298.427 Da
Monoisotopic mass	298.22564 Da
Source	ChEBI
InChIKey	GHPFVSRTGHIHCD-UHFFFAOYSA-O

SMILES

Cc1cc(CC(C)CC(C)(C)C)n([O-])c(=O)c1.[NH3+]CCO

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

Also called

2-hydroxyethanaminium 4-methyl-2-oxo-6-(2,4,4-trimethylpentyl)pyridin-1(2H)-olate (EXACT_SYNONYM)— chebi
1-Hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)-2-(1H)pyridinone 2-aminoethanol salt (EXACT_SYNONYM)— chebi
Piroctone ethanolamine salt (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:68890-66-4
kegg.drug:D05505
reaxys:7503297
wikipedia.en:Piroctone_olamine

Activity roles

Every antimicrobial role a source asserts for this compound — the unreduced evidence behind its antimicrobial_class.

CHEBI:86327 CHEBI:86327

Source concepts

Every upstream concept that resolved to this record. The merge is the product: this is what shows ChEBI and CARD are describing the same structure.

Upstream concepts merged into this record
Source	Native ID	Label	Minted CURIE	Version
CHEBI	`CHEBI:59008`	piroctone olamine	`antibioticmech:chebi-80213755c2`	2026-08-30

Curation history

SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Seeded from data/raw/ inventories (CHEBI)
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories

Provenance

Seeded by scripts/seed_from_sources.py from the committed inventories in data/raw/. View the record.