6beta-Hydroxy-5beta-pregnane-3,20-dione
TL;DR: 6beta-Hydroxy-5beta-pregnane-3,20-dione (CAS 57967-98-3) is a chemical compound with molecular formula C21H32O3 and molecular weight 332.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,6R,8R,9S,10R,13S,14S,17S)-17-acetyl-6-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
Also Known As: 6beta-Hydroxy-5beta-pregnane-3,20-dione, 6-hydroxypregnane-3,20-dione, Pregnane-3,20-dione, 6-hydroxy-, (5beta,6beta)-, (5R,6R,8R,9S,10R,13S,14S,17S)-17-acetyl-6-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
| Molecular Formula | C21H32O3 |
|---|---|
| Molecular Weight | 332.24 g/mol |
| LogP | 3.7742 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.23514 |
| Heavy Atoms | 24 |
| Complexity | 569.43115 |
Chemical Identifiers
| CAS Number | 57967-98-3 |
|---|---|
| SMILES | CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@H]4[C@@]3(CCC(=O)C4)C)O)C |
Product Overview
6beta-Hydroxy-5beta-pregnane-3,20-dione (CAS 57967-98-3), with molecular formula C21H32O3 and molecular weight 332.24 g/mol. IUPAC: (5R,6R,8R,9S,10R,13S,14S,17S)-17-acetyl-6-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 6beta-Hydroxy-5beta-pregnane-3,20-dione
Property Insights of 6beta-Hydroxy-5beta-pregnane-3,20-dione
The XLogP value of 3.7742 indicates that 6beta-Hydroxy-5beta-pregnane-3,20-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, 6beta-Hydroxy-5beta-pregnane-3,20-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6beta-Hydroxy-5beta-pregnane-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 6beta-Hydroxy-5beta-pregnane-3,20-dione?
The CAS number of 6beta-Hydroxy-5beta-pregnane-3,20-dione is 57967-98-3.
What is the molecular formula of 6beta-Hydroxy-5beta-pregnane-3,20-dione?
The molecular formula of 6beta-Hydroxy-5beta-pregnane-3,20-dione is C21H32O3.
What is the molecular weight of 6beta-Hydroxy-5beta-pregnane-3,20-dione?
The molecular weight of 6beta-Hydroxy-5beta-pregnane-3,20-dione is 332.24 g/mol.
Where can I buy 6beta-Hydroxy-5beta-pregnane-3,20-dione?
You can request a quote for 6beta-Hydroxy-5beta-pregnane-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 6beta-Hydroxy-5beta-pregnane-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 6beta-Hydroxy-5beta-pregnane-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.