17-Hydroxypregnane-3,20-dione
TL;DR: 17-Hydroxypregnane-3,20-dione (CAS 570-59-2) 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.
17-acetyl-17-hydroxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: 17-Hydroxypregnane-3,20-dione, A-Pregnan-17-ol-3,20-dione, 17a-hydroxy-5a-pregnane-3,20-dione, 1-acetyl-1-hydroxy-9a,11a-dimethyl-dodecahydro-2H-cyclopenta[a]phenanthren-7-one, 1-acetyl-1-hydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-one
| Molecular Formula | C21H32O3 |
|---|---|
| Molecular Weight | 332.24 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.23514 |
| Heavy Atoms | 24 |
| Complexity | 584.0 |
Chemical Identifiers
| CAS Number | 570-59-2 |
|---|---|
| SMILES | CC(=O)C1(CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C)O |
| InChIKey | UUOHXXXJRQGPLC-UHFFFAOYSA-N |
Product Overview
17-Hydroxypregnane-3,20-dione (CAS 570-59-2), with molecular formula C21H32O3 and molecular weight 332.24 g/mol. IUPAC: 17-acetyl-17-hydroxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 17-Hydroxypregnane-3,20-dione
Property Insights of 17-Hydroxypregnane-3,20-dione
The XLogP value of 3.2 indicates that 17-Hydroxypregnane-3,20-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 17-Hydroxypregnane-3,20-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17-Hydroxypregnane-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 17-Hydroxypregnane-3,20-dione?
The CAS number of 17-Hydroxypregnane-3,20-dione is 570-59-2.
What is the molecular formula of 17-Hydroxypregnane-3,20-dione?
The molecular formula of 17-Hydroxypregnane-3,20-dione is C21H32O3.
What is the molecular weight of 17-Hydroxypregnane-3,20-dione?
The molecular weight of 17-Hydroxypregnane-3,20-dione is 332.24 g/mol.
Where can I buy 17-Hydroxypregnane-3,20-dione?
You can request a quote for 17-Hydroxypregnane-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 17-Hydroxypregnane-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 17-Hydroxypregnane-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.