CAS 2753-30-2|Gedunin
Introduction：Basic information about CAS 2753-30-2|Gedunin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Gedunin | ||
|---|---|---|---|
| CAS Number | 2753-30-2 | Molecular Weight | 482.56500 |
| Density | 1.28g/cm3 | Boiling Point | 594.3ºC at 760mmHg |
| Molecular Formula | C28H34O7 | Melting Point | / |
| MSDS | / | Flash Point | 313.2ºC |
Names
| Name | gedunin |
|---|---|
| Synonym | More Synonyms |
Gedunin BiologicalActivity
| Description | Gedunin is a limonoid with anti-cancer, anti-viral, anti-inflammatory and insecticidal activities. Gedunin acts as a potent Hsp90 inhibitor and induces the degradation of Hsp90-dependent client proteins. Geduni may obstructs the entry of SARS-CoV-2 virus into human host cells and can be used for COVID-19 research[3]. |
|---|---|
| Related Catalog | Research Areas >>CancerSignaling Pathways >>Metabolic Enzyme/Protease >>HSPResearch Areas >>InfectionResearch Areas >>Inflammation/ImmunologySignaling Pathways >>Cell Cycle/DNA Damage >>HSP |
| Target | HSP90 |
| In Vitro | Gedunin (0.5-30 μM) inhibits CaCo-2 colon cancer cell proliferationin a dose-dependent manner, and the IC50 value is 16.83 µM[1]. |
| References | [1]. Shaikh J Uddin, et al. Gedunin, a limonoid from Xylocarpus granatum, inhibits the growth of CaCo-2 colon cancer cell line in vitro. Phytother Res. 2007 Aug;21(8):757-61. [2]. Gary E L Brandt, et al. Gedunin, a novel hsp90 inhibitor: semisynthesis of derivatives and preliminary structure-activity relationships. J Med Chem. 2008 Oct 23;51(20):6495-502 [3]. Seshu Vardhan, et al. Virtual screening by targeting proteolytic sites of furin and TMPRSS2 to propose potential compounds obstructing the entry of SARS-CoV-2 virus into human host cells. J Tradit Complement Med. 2021 Apr 12. |
Chemical & Physical Properties
| Density | 1.28g/cm3 |
|---|---|
| Boiling Point | 594.3ºC at 760mmHg |
| Molecular Formula | C28H34O7 |
| Molecular Weight | 482.56500 |
| Flash Point | 313.2ºC |
| Exact Mass | 482.23000 |
| PSA | 95.34000 |
| LogP | 4.56070 |
| Vapour Pressure | 4.31E-14mmHg at 25°C |
| Index of Refraction | 1.581 |
| InChIKey | YJXDGWUNRYLINJ-POZBICLPSA-N |
| SMILES | CC(=O)OC1CC2C(C)(C)C(=O)C=CC2(C)C2CCC3(C)C(c4ccoc4)OC(=O)C4OC43C12C |
Synonyms
| Gedunin,(1S,3aS,4aR,4bS,5R,6aR,10aR,10bR,12aS)-5-(Acetyloxy)-1-(3-furanyl)-1,5,6,6a,7,10a,10b,11,12,12a,decahydro-4b,7,7,10a,12a,-pentamethyloxireno[c]phenanthro[1,2-d]pyran-3,8(3aH,4bH)-dione |
| Gedunine |
