ferrostatin-1 (CHEBI:173086)

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ChEBI Name	ferrostatin-1

ChEBI ID	CHEBI:173086

Definition	An ethyl ester resulting from the formal condensation of the carboxy group of 3-amino-4-(cyclohexylamino)benzoic acid with ethanol. It is a potent inhibitor of ferroptosis, a distinct non-apoptotic form of cell death caused by lipid peroxidation. It is also a radical-trapping antioxidant and has the ability to reduce the accumulation of lipid peroxides and chain-carrying peroxyl radicals.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

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Formula

C15H22N2O2

Net Charge

Average Mass

262.353

Monoisotopic Mass

262.16813

InChI

InChI=1S/C15H22N2O2/c1-2-19-15(18)11-8-9-14(13(16)10-11)17-12-6-4-3-5-7-12/h8-10,12,17H,2-7,16H2,1H3

InChIKey

UJHBVMHOBZBWMX-UHFFFAOYSA-N

SMILES

CCOC(=O)C1=CC(N)=C(NC2CCCCC2)C=C1

Roles Classification
Chemical Role(s):	antioxidant A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. radical scavenger A role played by a substance that can react readily with, and thereby eliminate, radicals. Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	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 agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.

Application(s):	radiation protective agent Any compound that is able to protect normal cells from the damage caused by radiation therapy. neuroprotective agent Any compound that can be used for the treatment of neurodegenerative disorders.

ChEBI Ontology
Outgoing	ferrostatin-1 (CHEBI:173086) has role antifungal agent (CHEBI:35718) ferrostatin-1 (CHEBI:173086) has role antioxidant (CHEBI:22586) ferrostatin-1 (CHEBI:173086) has role ferroptosis inhibitor (CHEBI:173084) ferrostatin-1 (CHEBI:173086) has role neuroprotective agent (CHEBI:63726) ferrostatin-1 (CHEBI:173086) has role radiation protective agent (CHEBI:66987) ferrostatin-1 (CHEBI:173086) has role radical scavenger (CHEBI:48578) ferrostatin-1 (CHEBI:173086) is a ethyl ester (CHEBI:23990) ferrostatin-1 (CHEBI:173086) is a primary arylamine (CHEBI:50471) ferrostatin-1 (CHEBI:173086) is a substituted aniline (CHEBI:48975)

Incoming	SRS11-92 (CHEBI:173095) has functional parent ferrostatin-1 (CHEBI:173086)

IUPAC Name

ethyl 3-amino-4-(cyclohexylamino)benzoate

Synonyms	Sources
3-amino-4-cyclohexylaminobenzoic acid ethyl ester	ChEBI
Fer-1	ChEBI
ferrrostatin 1	ChEBI

Registry Number	Type	Source
347174-05-4	CAS Registry Number	ChEBI

Last Modified

26 May 2021