8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-
TL;DR: 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl- (CAS 73522-34-6) is a chemical compound with molecular formula C24H36O6 and molecular weight 420.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[2-(8-methoxy-7,7-dimethyl-3-oxo-9-oxatricyclo[6.2.2.01,6]dodecan-2-yl)ethyl]-2-methyl-3-oxocyclopentyl] acetate
Also Known As: 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-, 3H-3,8a-Ethano-1H-2-benzopyran-7(8H)-one, 8-[2-[2-(acetyloxy)-1-methyl-5-oxocyclopentyl]ethyl]hexahydro-3-methoxy-4,4-dimethyl-, [3S-[3I+/-,4aI(2),8I+/-(1R*,2R*),8aI+/-]]-
| Molecular Formula | C24H36O6 |
|---|---|
| Molecular Weight | 420.25 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.2512 |
| Heavy Atoms | 30 |
| Complexity | 759.0 |
Chemical Identifiers
| CAS Number | 73522-34-6 |
|---|---|
| SMILES | CC(=O)OC1CCC(=O)C1(C)CCC2C(=O)CCC3C24CCC(C3(C)C)(OC4)OC |
| InChIKey | NEQMZJDCKGAJQW-UHFFFAOYSA-N |
Product Overview
8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl- (CAS 73522-34-6), with molecular formula C24H36O6 and molecular weight 420.25 g/mol. IUPAC: [2-[2-(8-methoxy-7,7-dimethyl-3-oxo-9-oxatricyclo[6.2.2.01,6]dodecan-2-yl)ethyl]-2-methyl-3-oxocyclopentyl] acetate.
Chemical Property Profile of 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-
Property Insights of 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-. Following Lipinski's Rule of Five, 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-?
The CAS number of 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl- is 73522-34-6.
What is the molecular formula of 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-?
The molecular formula of 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl- is C24H36O6.
What is the molecular weight of 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-?
The molecular weight of 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl- is 420.25 g/mol.
Where can I buy 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-?
You can request a quote for 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 8,14-Seco-3,19-epoxyandrostane-8,14-dione, 17-acetoxy-3.beta.-methoxy-4,4-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.