6-Hydroxypregn-4-ene-3,11,20-trione
TL;DR: 6-Hydroxypregn-4-ene-3,11,20-trione (CAS 34153-34-9) is a chemical compound with molecular formula C21H28O4 and molecular weight 344.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,8S,9S,10R,13S,14S,17S)-17-acetyl-6-hydroxy-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
Also Known As: KST-1A3978, 6-hydroxypregn-4-ene-3,11,20-trione, 6beta-Hydroxypregn-4-ene-3,11,20-trione, (6, A)-6-hydroxypregn-4-ene-3,11,20-trione
| Molecular Formula | C21H28O4 |
|---|---|
| Molecular Weight | 344.20 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 344.19876 |
| Heavy Atoms | 25 |
| Complexity | 692.0 |
Chemical Identifiers
| CAS Number | 34153-34-9 |
|---|---|
| SMILES | CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2C[C@H](C4=CC(=O)CC[C@]34C)O)C |
| InChIKey | OQHBUJSFKDUFCW-VTPSHUEJSA-N |
Product Overview
6-Hydroxypregn-4-ene-3,11,20-trione (CAS 34153-34-9), with molecular formula C21H28O4 and molecular weight 344.20 g/mol. IUPAC: (6R,8S,9S,10R,13S,14S,17S)-17-acetyl-6-hydroxy-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione.
Chemical Property Profile of 6-Hydroxypregn-4-ene-3,11,20-trione
Property Insights of 6-Hydroxypregn-4-ene-3,11,20-trione
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Hydroxypregn-4-ene-3,11,20-trione. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Hydroxypregn-4-ene-3,11,20-trione. Following Lipinski's Rule of Five, 6-Hydroxypregn-4-ene-3,11,20-trione has 1 hydrogen bond donor(s) and 4 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 6-Hydroxypregn-4-ene-3,11,20-trione?
The CAS number of 6-Hydroxypregn-4-ene-3,11,20-trione is 34153-34-9.
What is the molecular formula of 6-Hydroxypregn-4-ene-3,11,20-trione?
The molecular formula of 6-Hydroxypregn-4-ene-3,11,20-trione is C21H28O4.
What is the molecular weight of 6-Hydroxypregn-4-ene-3,11,20-trione?
The molecular weight of 6-Hydroxypregn-4-ene-3,11,20-trione is 344.20 g/mol.
Where can I buy 6-Hydroxypregn-4-ene-3,11,20-trione?
You can request a quote for 6-Hydroxypregn-4-ene-3,11,20-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxypregn-4-ene-3,11,20-trione?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxypregn-4-ene-3,11,20-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.