11-Hydroxypregna-4,6-diene-3,20-dione
TL;DR: 11-Hydroxypregna-4,6-diene-3,20-dione (CAS 21170-28-5) is a chemical compound with molecular formula C21H28O3 and molecular weight 328.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,11R,13S,14S,17S)-17-acetyl-11-hydroxy-10,13-dimethyl-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: KST-1A2655, 11-hydroxypregna-4,6-diene-3,20-dione, 11alpha-Hydroxypregna-4,6-diene-3,20-dione, (11, A)-11-hydroxypregna-4,6-diene-3,20-dione
| Molecular Formula | C21H28O3 |
|---|---|
| Molecular Weight | 328.20 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 328.20386 |
| Heavy Atoms | 24 |
| Complexity | 660.0 |
Chemical Identifiers
| CAS Number | 21170-28-5 |
|---|---|
| SMILES | CC(=O)[C@H]1CC[C@@H]2[C@@]1(C[C@H]([C@H]3[C@H]2C=CC4=CC(=O)CC[C@]34C)O)C |
| InChIKey | XEYDJPIWTXGAEZ-QJSKAATBSA-N |
Product Overview
11-Hydroxypregna-4,6-diene-3,20-dione (CAS 21170-28-5), with molecular formula C21H28O3 and molecular weight 328.20 g/mol. IUPAC: (8S,9S,10R,11R,13S,14S,17S)-17-acetyl-11-hydroxy-10,13-dimethyl-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 11-Hydroxypregna-4,6-diene-3,20-dione
Property Insights of 11-Hydroxypregna-4,6-diene-3,20-dione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11-Hydroxypregna-4,6-diene-3,20-dione. With a topological polar surface area (TPSA) of 54.4 Ų, 11-Hydroxypregna-4,6-diene-3,20-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-Hydroxypregna-4,6-diene-3,20-dione has 1 hydrogen bond donor(s) and 3 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-Hydroxypregna-4,6-diene-3,20-dione?
The CAS number of 11-Hydroxypregna-4,6-diene-3,20-dione is 21170-28-5.
What is the molecular formula of 11-Hydroxypregna-4,6-diene-3,20-dione?
The molecular formula of 11-Hydroxypregna-4,6-diene-3,20-dione is C21H28O3.
What is the molecular weight of 11-Hydroxypregna-4,6-diene-3,20-dione?
The molecular weight of 11-Hydroxypregna-4,6-diene-3,20-dione is 328.20 g/mol.
Where can I buy 11-Hydroxypregna-4,6-diene-3,20-dione?
You can request a quote for 11-Hydroxypregna-4,6-diene-3,20-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-Hydroxypregna-4,6-diene-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 11-Hydroxypregna-4,6-diene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.