SRS11-92 - ≥98% , CAS No.1467047-25-1

CAS: 1467047-25-1 Cat. No.: S414492 Fórmula: C₂₂H₂₈N₂O₂ Peso molecular: 352.47 PubChem CID: 71745064

GRADE & PURITY ≥98%

Synonyms

AA9Benzoic acid,4-​(cyclohexylamino)​-​3-​[(phenylmethyl)​amino]​-​,ethyl ester

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Visão geral

Information

SRS11-92 SRS11-92 (AA9), a Ferrostatin-1 (Fer-1) analogue, is a potent inhibitor of ferroptosis . SRS11-92 inhibits ferroptotic cell death induced by Erastin in HT-1080 human fibrosarcoma cells with EC50 of 6 nM.

Targets

HT-1080 ferroptotic cell death (Cell-based assay) 6 nM(EC50)

In vitro

SRS11-92 is efficacious in protecting human and mouse cellular models of FRDA treated with ferric ammonium citrate (FAC) and an inhibitor of glutathione synthesis (BSO). SRS11-92 decreases the cell death associated with frataxin knockdown in healthy human fibroblasts.

Cell Research(from reference)

Cell lines：murine I154F FRDA fibroblasts 

Concentrations：50 μM to 500 nM 

Incubation Time：48 h 

Specifications

Sinónimos

AA9Benzoic acid,4-​(cyclohexylamino)​-​3-​[(phenylmethyl)​amino]​-​,ethyl ester

Especificações e pureza

≥98%

Mecanismos bioquímicos e fisiológicos

SRS11-92 (AA9), a Ferrostatin-1 (Fer-1) analogue, is a potent inhibitor of ferroptosis. SRS11-92 inhibits ferroptotic cell death induced by Erastin in HT-1080 human fibrosarcoma cells with EC50 of 6 nM.

Condições de armazenamento de armazenamento

Protected from light,Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

488202297

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488202297

Sorrisos canónicos

CCOC(=O)C1=CC(=C(C=C1)NC2CCCCC2)NCC3=CC=CC=C3

IUPAC Name

ethyl 3-(benzylamino)-4-(cyclohexylamino)benzoate

InChIKey

VHQAJFNLPQULSV-UHFFFAOYSA-N

INCHI

1S/C22H28N2O2/c1-2-26-22(25)18-13-14-20(24-19-11-7-4-8-12-19)21(15-18)23-16-17-9-5-3-6-10-17/h3,5-6,9-10,13-15,19,23-24H,2,4,7-8,11-12,16H2,1H3

SMILES isoméricas

CCOC(=O)C1=CC(=C(C=C1)NC2CCCCC2)NCC3=CC=CC=C3

PubChem CID

71745064

Peso molecular

352.47

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Phenylmethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Phenylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylbenzamines
• Alternative Parents: Benzoic acid esters Aminobenzoic acids and derivatives Phenylalkylamines Benzylamines Benzoyl derivatives Aniline and substituted anilines Secondary alkylarylamines Cyclohexylamines Carboxylic acid esters Amino acids and derivatives Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylbenzamine - Aminobenzoic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Benzylamine - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Cyclohexylamine - Aralkylamine - Carboxylic acid ester - Amino acid or derivatives - Secondary amine - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Amine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Alvos associados (não humanos)

Leishmania major (2877 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

RAW264.7 (28094 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Solubility (25°C) In vitro DMSO: 70 mg/mL (198.59 mM); Ethanol: 70 mg/mL (198.59 mM); Water: Insoluble
• Sensibilidade: light sensitive
• Peso molecular: 352.500 g/mol
• XLogP3: 5.400
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 352.215 Da
• Monoisotopic Mass: 352.215 Da
• Topological Polar Surface Area: 50.400 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 416.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1467047-25-1, the molecular formula is C22H28N2O2, and the molecular weight is 352.47 g/mol. InChIKey VHQAJFNLPQULSV-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.