Aldosterone acetate
TL;DR: Aldosterone acetate (CAS 297-91-6) is a chemical compound with molecular formula C23H30O6 and molecular weight 402.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(8S,9S,10R,11S,13R,14S,17S)-13-formyl-11-hydroxy-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: aldosterone acetate, Aldosterone, monoacetate, Aldosterone monoacetate, d-Aldosterone acetate, Aldosterone-21-acetate
| Molecular Formula | C23H30O6 |
|---|---|
| Molecular Weight | 402.20 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 97.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.20422 |
| Heavy Atoms | 29 |
| Complexity | 784.0 |
Chemical Identifiers
| CAS Number | 297-91-6 |
|---|---|
| SMILES | CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C=O |
| InChIKey | HCJKXXMOOMBBPY-IEJDVFFQSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aldosterone acetate (CAS 297-91-6), with molecular formula C23H30O6 and molecular weight 402.20 g/mol. IUPAC: [2-[(8S,9S,10R,11S,13R,14S,17S)-13-formyl-11-hydroxy-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
Chemical Property Profile of Aldosterone acetate
Property Insights of Aldosterone acetate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aldosterone acetate. The TPSA of 97.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Aldosterone acetate. Following Lipinski's Rule of Five, Aldosterone acetate has 1 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 Aldosterone acetate?
The CAS number of Aldosterone acetate is 297-91-6.
What is the molecular formula of Aldosterone acetate?
The molecular formula of Aldosterone acetate is C23H30O6.
What is the molecular weight of Aldosterone acetate?
The molecular weight of Aldosterone acetate is 402.20 g/mol.
Where can I buy Aldosterone acetate?
You can request a quote for Aldosterone acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aldosterone acetate?
Yes, KEHONG BIO provides custom synthesis services for Aldosterone acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.