(2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione
TL;DR: (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione (CAS 10162-99-9) is a chemical compound with molecular formula C21H30O5 and molecular weight 362.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,5R,9R,10R,13R,14S,17S)-17-acetyl-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
Also Known As: Poststerone, Posterone, HY-N10040, 2beta,3beta,14-trihydroxy-5beta-pregn-7-ene-6,20-dione, 2,3,14-trihydroxypregn-7-ene-6,20-dione
| Molecular Formula | C21H30O5 |
|---|---|
| Molecular Weight | 362.21 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 362.20932 |
| Heavy Atoms | 26 |
| Complexity | 699.0 |
Chemical Identifiers
| CAS Number | 10162-99-9 |
|---|---|
| SMILES | CC(=O)[C@H]1CC[C@@]2([C@@]1(CC[C@H]3C2=CC(=O)[C@H]4[C@@]3(C[C@@H]([C@@H](C4)O)O)C)C)O |
| InChIKey | VNLQNGYIXVTQRR-NQPIQAHSSA-N |
Product Overview
(2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione (CAS 10162-99-9), with molecular formula C21H30O5 and molecular weight 362.21 g/mol. IUPAC: (2S,3R,5R,9R,10R,13R,14S,17S)-17-acetyl-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one.
Chemical Property Profile of (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione
Property Insights of (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione. Following Lipinski's Rule of Five, (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione has 3 hydrogen bond donor(s) and 5 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 (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione?
The CAS number of (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione is 10162-99-9.
What is the molecular formula of (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione?
The molecular formula of (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione is C21H30O5.
What is the molecular weight of (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione?
The molecular weight of (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione is 362.21 g/mol.
Where can I buy (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione?
You can request a quote for (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione?
Yes, KEHONG BIO provides custom synthesis services for (2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.