5alpha-Androstane-3beta,6alpha,17beta-triol
TL;DR: 5alpha-Androstane-3beta,6alpha,17beta-triol (CAS 49644-04-4) is a chemical compound with molecular formula C19H32O3 and molecular weight 308.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5S,6S,8R,9S,10R,13S,14S,17S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6,17-triol
Also Known As: Androstane-3,6,17-triol, 6alpha-Triol, Exemestane Impurity 28, 3beta,6alpha,17beta-Trihydroxy-5alpha-androstane, 5alpha-Androstane-3beta,6alpha,17beta-triol
| Molecular Formula | C19H32O3 |
|---|---|
| Molecular Weight | 308.24 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 308.23514 |
| Heavy Atoms | 22 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 49644-04-4 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C[C@@H]([C@@H]4[C@@]3(CC[C@@H](C4)O)C)O |
| InChIKey | OFAZPSYXUKIJIK-JGRZZSDMSA-N |
Product Overview
5alpha-Androstane-3beta,6alpha,17beta-triol (CAS 49644-04-4), with molecular formula C19H32O3 and molecular weight 308.24 g/mol. IUPAC: (3S,5S,6S,8R,9S,10R,13S,14S,17S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6,17-triol.
Chemical Property Profile of 5alpha-Androstane-3beta,6alpha,17beta-triol
Property Insights of 5alpha-Androstane-3beta,6alpha,17beta-triol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5alpha-Androstane-3beta,6alpha,17beta-triol. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5alpha-Androstane-3beta,6alpha,17beta-triol. Following Lipinski's Rule of Five, 5alpha-Androstane-3beta,6alpha,17beta-triol has 3 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 5alpha-Androstane-3beta,6alpha,17beta-triol?
The CAS number of 5alpha-Androstane-3beta,6alpha,17beta-triol is 49644-04-4.
What is the molecular formula of 5alpha-Androstane-3beta,6alpha,17beta-triol?
The molecular formula of 5alpha-Androstane-3beta,6alpha,17beta-triol is C19H32O3.
What is the molecular weight of 5alpha-Androstane-3beta,6alpha,17beta-triol?
The molecular weight of 5alpha-Androstane-3beta,6alpha,17beta-triol is 308.24 g/mol.
Where can I buy 5alpha-Androstane-3beta,6alpha,17beta-triol?
You can request a quote for 5alpha-Androstane-3beta,6alpha,17beta-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5alpha-Androstane-3beta,6alpha,17beta-triol?
Yes, KEHONG BIO provides custom synthesis services for 5alpha-Androstane-3beta,6alpha,17beta-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.