structure of THPN

THPN

CAS No.: 100079-26-3
M. Wt: 266.33300
M. Fa: C15H22O4
InChI Key: -
Appearance: White To Beige to Brown Powder

Names and Identifiers of THPN

CAS Number

100079-26-3

IUPAC Name

1-[3,4,5-tris(oxidanyl)phenyl]nonan-1-one

Canonical SMILES

CCCCCCCCC(=O)C1=CC(=C(C(=C1)O)O)O

Physical and chemical properties of THPN

Boiling Point

483.5ºC at 760mmHg

Density

1.148g/cm3

Exact Mass

266.15200

Flash Point

260.3ºC

Index of Refraction

1.554

LogP

3.73670

Molecular Formula

C15H22O4

Molecular Weight

266.33300

PSA

77.76000

Storage condition

2-8°C

Vapour Pressure

5.69E-10mmHg at 25°C

Safety Information of THPN

Pictograms

Signal Word

Warning

Safety Data Sheet

Supports customized editing of SDS information and downloading in PDF documents.

Applications of THPN

THPN has potential applications in cancer therapy, particularly for melanoma treatment due to its ability to induce autophagic cell death. Its specificity for Nur77 allows for targeted therapeutic strategies that may reduce side effects associated with traditional chemotherapy. Additionally, THPN's role in modulating inflammatory responses suggests potential applications in treating inflammatory diseases. Ongoing research aims to explore its efficacy further and develop derivatives that could enhance its therapeutic profile.

Interaction Studies of THPN

Studies on THPN have focused on its interactions with Nur77 and other mitochondrial proteins. The compound's ability to induce conformational changes in Nur77 upon binding is crucial for its function. Interaction studies have demonstrated that THPN facilitates the association of Nur77 with mitochondrial proteins like ANT1 (adenine nucleotide translocator), which is involved in regulating mitochondrial membrane permeability. These studies are essential for understanding the molecular mechanisms underlying THPN's biological effects and for optimizing its use as a therapeutic agent.

Biological Activity of THPN

THPN exhibits potent biological activity by specifically targeting Nur77, which plays a crucial role in regulating various cellular functions such as metabolism, inflammation, and apoptosis. In experimental models, THPN has been shown to induce autophagic cell death in melanoma cells by promoting the movement of Nur77 into mitochondria and disrupting mitochondrial functions. This mechanism is significant because it allows THPN to overcome resistance mechanisms present in melanoma cells against conventional apoptosis-inducing drugs. Furthermore, studies indicate that THPN's action can inhibit tumor development and metastasis in vivo, highlighting its potential as an anti-cancer agent.

Physical sample testing spectrum (NMR) of THPN

Physical sample testing spectrum (NMR) of THPN