Cas no 84745-94-8 (Qingyangshengenin)
Qingyangshengenin Chemical and Physical Properties
Names and Identifiers
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- Qingyangshengenin
- (3beta,12beta,14beta,17alpha)-17-(acetyloxy)-3,8,14,17-tetrahydroxyandrost-5-en-12-yl 4-hydroxybenzoate
- QINGYANGSHENGENIN (RG)
- QINGYANGSHENGENIN A
- Qingyanshengenin
- Quingyangshengenin
- [ "" ]
- [(9S,10R,13S,14R,17S)-17-Acetyl-3,8,14,17-tetrahydroxy-10,13-dimethyl-1,2,3,4,7,9,11,12,15,16-decahy
- (3β,12β,14β,17α)-3,8,14,17-Tetrahydroxy-12-[(4-hydroxybenzoyl)oxy]pregn-5-en-20-one (ACI)
- NSC 379666
- 84745-94-8
- CHEMBL4082412
- CS-0016790
- HY-N1375
- [(3S,8S,9R,10R,12R,13S,14R,17S)-17-acetyl-3,8,14,17-tetrahydroxy-10,13-dimethyl-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-12-yl] 4-hydroxybenzoate
- (1S,3AR,3BS,7S,9AR,9BR,11R,11AS)-1-ACETYL-1,3A,3B,7-TETRAHYDROXY-9A,11A-DIMETHYL-2H,3H,4H,6H,7H,8H,9H,9BH,10H,11H-CYCLOPENTA[A]PHENANTHREN-11-YL 4-HYDROXYBENZOATE
- DA-67055
- Q-100855
- AKOS037514810
- Cynanchagenin
- CHEBI:184101
- MFCD09752816
-
- MDL: MFCD09752816
- Inchi: 1S/C28H36O8/c1-16(29)26(33)12-13-28(35)25(26,3)22(36-23(32)17-4-6-19(30)7-5-17)15-21-24(2)10-9-20(31)14-18(24)8-11-27(21,28)34/h4-8,20-22,30-31,33-35H,9-15H2,1-3H3/t20-,21+,22+,24-,25+,26+,27-,28+/m0/s1
- InChI Key: IMRGSWAJVVVYOW-ZCARJHNXSA-N
- SMILES: C[C@@]12[C@](O)(C(=O)C)CC[C@@]1([C@@]1(CC=C3C[C@H](CC[C@]3(C)[C@H]1C[C@H]2OC(C1C=CC(O)=CC=1)=O)O)O)O
Computed Properties
- Exact Mass: 500.24100
- Monoisotopic Mass: 500.24101810 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 36
- Rotatable Bond Count: 4
- Complexity: 971
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 8
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.5
- Topological Polar Surface Area: 145
- Molecular Weight: 500.6
Experimental Properties
- Color/Form: Cryst.
- Density: 1.4000
- Boiling Point: 686.4°Cat760mmHg
- Flash Point: 226.2°C
- Refractive Index: 1.646
- PSA: 144.52000
- LogP: 2.40110
- Sensitiveness: Sensitive to light
Qingyangshengenin Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | Q115688-25mg |
Qingyangshengenin |
84745-94-8 | ,≥98% | 25mg |
¥617.90 | 2023-09-01 | |
| ChemFaces | CFN97401-20mg |
Qingyangshengenin |
84745-94-8 | >=98% | 20mg |
$138 | 2021-07-22 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R030105-25mg |
Qingyangshengenin |
84745-94-8 | 98%() | 25mg |
¥536 | 2024-05-21 | |
| ChemScence | CS-0016790-5mg |
Qingyangshengenin |
84745-94-8 | 5mg |
$336.0 | 2022-04-26 | ||
| ChemScence | CS-0016790-10mg |
Qingyangshengenin |
84745-94-8 | 10mg |
$571.0 | 2022-04-26 | ||
| Chengdu Biopurify Phytochemicals Ltd | BP1185-20mg |
Cynanchagenin |
84745-94-8 | 98% | 20mg |
$50 | 2023-09-20 | |
| Chengdu Biopurify Phytochemicals Ltd | BP1185-100mg |
Cynanchagenin |
84745-94-8 | 98% | 100mg |
$360 | 2023-09-20 | |
| Chengdu Biopurify Phytochemicals Ltd | BP1185-10mg |
Cynanchagenin |
84745-94-8 | 98% | 10mg |
$35 | 2023-09-20 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | T7024-1 mg |
Qingyangshengenin |
84745-94-8 | 99.62% | 1mg |
¥1272.00 | 2022-04-26 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | T7024-5 mg |
Qingyangshengenin |
84745-94-8 | 99.62% | 5mg |
¥3055.00 | 2022-04-26 |
Qingyangshengenin Suppliers
Qingyangshengenin Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
Related Categories
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Gluco/mineralocorticoids, progestogins and derivatives
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Pregnane steroids Gluco/mineralocorticoids, progestogins and derivatives
- Pharmaceutical and Biochemical Products Pharmaceutical Active Ingredients Standard Substances
Additional information on Qingyangshengenin
Qingyangshengenin (CAS No. 84745-94-8): A Comprehensive Overview of Its Structural, Pharmacological, and Therapeutic Implications
Qingyangshengenin, identified by its Chemical Abstracts Service (CAS) number 84745-94-8, is a naturally occurring compound that has garnered significant attention in the field of pharmaceutical research due to its unique chemical structure and promising biological activities. This compound, derived from traditional Chinese medicinal sources, has been the subject of extensive studies aimed at elucidating its mechanism of action, potential therapeutic applications, and interactions with biological targets.
The molecular structure of Qingyangshengenin exhibits a complex framework characterized by multiple functional groups, including hydroxyl and methoxy substituents, which contribute to its distinctive chemical properties. These structural features not only influence its solubility and stability but also play a crucial role in its interactions with biological molecules. Advanced spectroscopic techniques such as nuclear magnetic resonance (NMR) spectroscopy and mass spectrometry have been instrumental in determining the precise configuration of this compound, providing valuable insights into its stereochemistry.
In recent years, the pharmacological profile of Qingyangshengenin has been extensively investigated, revealing a wide spectrum of biological activities. Studies have demonstrated its potent antioxidant properties, which are attributed to its ability to scavenge reactive oxygen species and inhibit oxidative stress-mediated cellular damage. This antioxidant activity has positioned Qingyangshengenin as a potential candidate for the development of therapeutic strategies against various oxidative stress-related disorders, including neurodegenerative diseases and cardiovascular conditions.
Beyond its antioxidant effects, Qingyangshengenin has shown significant anti-inflammatory properties. Preclinical studies have indicated that it can modulate inflammatory pathways by inhibiting the production of pro-inflammatory cytokines such as tumor necrosis factor-alpha (TNF-α) and interleukin-6 (IL-6). These findings suggest that Qingyangshengenin may be beneficial in managing chronic inflammatory diseases such as rheumatoid arthritis and inflammatory bowel disease.
The anticancer potential of Qingyangshengenin has also been a focal point of research. Investigations have revealed that it can induce apoptosis in cancer cells by activating intrinsic apoptotic pathways and inhibiting anti-apoptotic proteins. Furthermore, it has demonstrated the ability to disrupt cancer cell proliferation by interfering with key signaling pathways involved in cell cycle regulation. These mechanisms make Qingyangshengenin an attractive candidate for further development as an anticancer agent, potentially offering a novel therapeutic approach for various types of cancer.
In addition to its well-documented biological activities, Qingyangshengenin has shown promise in other therapeutic areas. For instance, studies have explored its neuroprotective effects, suggesting that it may help protect against neuronal damage caused by ischemia and neurotoxic insults. This neuroprotective activity could make it a valuable component in strategies aimed at preventing or mitigating neurodegenerative diseases such as Alzheimer's disease and Parkinson's disease.
The pharmacokinetic properties of Qingyangshengenin, as determined through in vitro and in vivo studies, provide further insights into its potential clinical applications. Research indicates that it exhibits good oral bioavailability and distributes widely throughout various tissues, suggesting that it may be effectively delivered systemically. However, challenges related to its metabolic stability and potential drug-drug interactions need to be addressed through further optimization.
The synthesis and isolation of Qingyangshengenin remain challenging due to its complex structure and limited natural abundance. However, advances in synthetic chemistry have enabled the development of more efficient methodologies for its production. These synthetic approaches not only facilitate the availability of the compound for research purposes but also open avenues for structural modifications aimed at enhancing its pharmacological efficacy.
The integration of computational methods such as molecular docking and virtual screening has significantly accelerated the discovery process for natural products like Qingyangshengenin. These computational tools allow researchers to predict potential binding interactions between the compound and target proteins with high accuracy, thereby guiding experimental investigations and optimizing lead compounds for therapeutic development.
The growing body of evidence supporting the therapeutic potential of Qingyangshengenin has prompted several clinical trials aimed at evaluating its safety and efficacy in human populations. While these trials are still in progress, preliminary results are promising and suggest that Qingyangshengenin may offer significant benefits in treating various diseases without causing severe side effects.
In conclusion, Qingyangshengenin, identified by its CAS number 84745-94-8, is a multifaceted compound with a rich pharmacological profile. Its unique structural features contribute to its diverse biological activities, including antioxidant, anti-inflammatory, anticancer, and neuroprotective effects. While challenges remain in terms of synthesis, pharmacokinetics, and clinical translation, the ongoing research into this compound holds great promise for the development of novel therapeutic strategies across multiple medical disciplines.