CAS 571203-78-6|Erastin

Introduction:Basic information about CAS 571203-78-6|Erastin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameErastin
CAS Number571203-78-6Molecular Weight547.044
Density1.3±0.1 g/cm3Boiling Point721.9±70.0 °C at 760 mmHg
Molecular FormulaC30H31ClN4O4Melting Point/
MSDSChineseUSAFlash Point390.4±35.7 °C
Symbol
GHS06
Signal WordDanger

Names

Name2-[1-[4-[2-(4-chlorophenoxy)acetyl]piperazin-1-yl]ethyl]-3-(2-ethoxyphenyl)quinazolin-4-one
SynonymMore Synonyms

Erastin BiologicalActivity

DescriptionErastin is a ferroptosis activator.
Related CatalogSignaling Pathways >>Apoptosis >>FerroptosisResearch Areas >>Cancer
In VitroErastin triggers oxidative, iron-dependent cell death. Treatment of NRAS-mutant HT-1080 fibrosarcoma cells with the RSL molecule erastin (10 µM) results in a time-dependent increase in cytosolic and lipid ROS beginning at 2 hours[1]. Cell death triggered by erastin is significantly inhibited by antioxidants (e.g., α-tocopherol, butylated hydroxytoluene, and β-carotene) and iron chelators (e.g., deferoxamine), suggesting that ROS- and iron-dependent signaling is required for erastin-induced ferroptosis. Erastin can directly bind to VDAC2/3 in BJeLR cells. Knockdown of VDAC2 and VDAC3, but not VDAC1, leads to erastin resistance. Erastin has the ability to reduce glutathione level by directly inhibiting cystine/glutamate antiporter system Xc− activity, with activation of the ER stress response[2]. Erastin potently inhibits HT-29 cell survival. Erastin shows a dose-dependent effect, and 30 μM of erastin displays the most dramatic effect[3].
In VivoIntraperitoneal injection of erastin at well-tolerated doses dramatically inhibits HT-29 xenograft growth in severe combined immunodeficient mice[3].
Cell AssayTo test erastin’s activity on colorectal cancer cell survival, HT-29 cells are treated with increasing concentrations of erastin (0.1–30 μM). MTT assay was performed[3].
Animal AdminMice: Mice are treated daily with 10 or 30 mg/kg body weight of erastin (intraperitoneal injection, for 4 weeks) or vehicle control (Saline). Tumor volumes are calculated. Mice body weights are also recorded every week[3].
References

[1]. Dixon SJ, et al. Ferroptosis: an iron-dependent form of nonapoptotic cell death. Cell. 2012 May 25;149(5):1060-72.

[2]. Xie Y, et al. Ferroptosis: process and function. Cell Death Differ. 2016 Mar;23(3):369-79.

[3]. Huo H, et al. Erastin Disrupts Mitochondrial Permeability Transition Pore (mPTP) and Induces Apoptotic Death of Colorectal Cancer Cells. PLoS One. 2016 May 12;11(5):e0154605.

Chemical & Physical Properties

Density1.3±0.1 g/cm3
Boiling Point721.9±70.0 °C at 760 mmHg
Molecular FormulaC30H31ClN4O4
Molecular Weight547.044
Flash Point390.4±35.7 °C
Exact Mass546.203369
PSA76.90000
LogP4.75
Appearance of Characterswhite to beige
Vapour Pressure0.0±2.3 mmHg at 25°C
Index of Refraction1.634
InChIKeyBKQFRNYHFIQEKN-UHFFFAOYSA-N
SMILESCCOc1ccccc1-n1c(C(C)N2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O
Storage condition−20°C
Water SolubilityDMSO: soluble5mg/mL, clear (warmed)

Safety Information

Symbol
GHS06
Signal WordDanger
Hazard StatementsH301
Precautionary StatementsP301 + P310 + P330
Personal Protective EquipmentEyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges
Hazard CodesT
Risk Phrases25
Safety Phrases45
RIDADRUN 2811 6.1/PG 3

Articles11

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Synonyms

2-[1-[4-[2-(4-chlorophenoxy)acetyl]-1-piperazinyl]ethyl]-3-(2-ethoxyphenyl)-4(3H)-Quinazolinone
2-(1-{4-[(4-Chlorophenoxy)acetyl]-1-piperazinyl}ethyl)-3-(2-ethoxyphenyl)-4(3H)-quinazolinone
s7242
2-(1-{4-[2-(4-chloro-phenoxy)-acetyl]-piperazin-1-yl}-ethyl)-3-(2-ethoxy-phenyl)-3H-quinazolin-4-one
2-(1-{4-[(4-chlorophenoxy)acetyl]piperazin-1-yl}ethyl)-3-(2-ethoxyphenyl)quinazolin-4(3H)-one
4(3H)-Quinazolinone, 2-[1-[4-[2-(4-chlorophenoxy)acetyl]-1-piperazinyl]ethyl]-3-(2-ethoxyphenyl)-
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