Hydrocortisone 11,17,21-Triacetate
TL;DR: Hydrocortisone 11,17,21-Triacetate (CAS 3517-51-9) is a chemical compound with molecular formula C27H36O8 and molecular weight 488.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(11,17-diacetyloxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate
Also Known As: Hydrocortisone 11,17,21-Triacetate, [2-(11,17-diacetyloxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate
| Molecular Formula | C27H36O8 |
|---|---|
| Molecular Weight | 488.24 g/mol |
| LogP | 3.494 |
| Topological Polar Surface Area | 113.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 488.24103 |
| Heavy Atoms | 35 |
| Complexity | 997.1403 |
Chemical Identifiers
| CAS Number | 3517-51-9 |
|---|---|
| SMILES | CC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34C)OC(=O)C)C)OC(=O)C |
Product Overview
Hydrocortisone 11,17,21-Triacetate (CAS 3517-51-9), with molecular formula C27H36O8 and molecular weight 488.24 g/mol. IUPAC: [2-(11,17-diacetyloxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate.
Chemical Property Profile of Hydrocortisone 11,17,21-Triacetate
Property Insights of Hydrocortisone 11,17,21-Triacetate
The XLogP value of 3.494 indicates that Hydrocortisone 11,17,21-Triacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.04 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydrocortisone 11,17,21-Triacetate. Following Lipinski's Rule of Five, Hydrocortisone 11,17,21-Triacetate has 0 hydrogen bond donor(s) and 8 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 Hydrocortisone 11,17,21-Triacetate?
The CAS number of Hydrocortisone 11,17,21-Triacetate is 3517-51-9.
What is the molecular formula of Hydrocortisone 11,17,21-Triacetate?
The molecular formula of Hydrocortisone 11,17,21-Triacetate is C27H36O8.
What is the molecular weight of Hydrocortisone 11,17,21-Triacetate?
The molecular weight of Hydrocortisone 11,17,21-Triacetate is 488.24 g/mol.
Where can I buy Hydrocortisone 11,17,21-Triacetate?
You can request a quote for Hydrocortisone 11,17,21-Triacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydrocortisone 11,17,21-Triacetate?
Yes, KEHONG BIO provides custom synthesis services for Hydrocortisone 11,17,21-Triacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.