11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯
TL;DR: 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯 (CAS 16463-74-4) is a chemical compound with molecular formula C23H32O6 and molecular weight 404.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯
[11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
Also Known As: Hydrocortisone EP Impurity J, 11,21-dihydroxy-3,20-dioxopregn-4-en-17-yl acetate, [11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate, 11, A,21-Dihydroxy-3,20-dioxopregn-4-en-17-yl acetate; (8S,9S,10R,11S,13S,14S,17R)-11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl acetate
| Molecular Formula | C23H32O6 |
|---|---|
| Molecular Weight | 404.22 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.21988 |
| Heavy Atoms | 29 |
| Complexity | 786.0 |
Chemical Identifiers
| CAS Number | 16463-74-4 |
|---|---|
| SMILES | CC(=O)OC1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34C)O)C)C(=O)CO |
| InChIKey | HDEDWNHZBWFQCB-UHFFFAOYSA-N |
Product Overview
11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯 (CAS 16463-74-4), with molecular formula C23H32O6 and molecular weight 404.22 g/mol. IUPAC: [11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate.
Chemical Property Profile of 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯
Property Insights of 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯. Following Lipinski's Rule of Five, 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯 has 2 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 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯?
The CAS number of 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯 is 16463-74-4.
What is the molecular formula of 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯?
The molecular formula of 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯 is C23H32O6.
What is the molecular weight of 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯?
The molecular weight of 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯 is 404.22 g/mol.
Where can I buy 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯?
You can request a quote for 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯?
Yes, KEHONG BIO provides custom synthesis services for 11,21-二羟基-3,20-二氧代孕甾-4-烯-17-基乙酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.