6 Alpha-hydroxy(allo)tetrahydrocortisol
TL;DR: 6 Alpha-hydroxy(allo)tetrahydrocortisol (CAS 77648-51-2) is a chemical compound with molecular formula C21H34O6 and molecular weight 382.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-1-[(3R,5S,6S,8S,9S,10S,11S,13S,14S,17R)-3,6,11,17-tetrahydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone
Also Known As: 3,6,11,17,21-Pentahydroxypregnan-20-one, 6 Alpha-hydroxy(allo)tetrahydrocortisol, 6alpha-Hydroxy(allo)tetrahydrocortisol, 2-hydroxy-1-[(3R,5S,6S,8S,9S,10S,11S,13S,14S,17R)-3,6,11,17-tetrahydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone, 3alpha,6alpha,11beta,17,21-Pentahydroxy-5alpha-pregnan-20-one
| Molecular Formula | C21H34O6 |
|---|---|
| Molecular Weight | 382.24 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.23553 |
| Heavy Atoms | 27 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 77648-51-2 |
|---|---|
| SMILES | C[C@]12CC[C@H](C[C@@H]1[C@H](C[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)O)O)O |
| InChIKey | YZEJGGKLJNZFGY-QZJGIPCSSA-N |
Product Overview
6 Alpha-hydroxy(allo)tetrahydrocortisol (CAS 77648-51-2), with molecular formula C21H34O6 and molecular weight 382.24 g/mol. IUPAC: 2-hydroxy-1-[(3R,5S,6S,8S,9S,10S,11S,13S,14S,17R)-3,6,11,17-tetrahydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone.
Chemical Property Profile of 6 Alpha-hydroxy(allo)tetrahydrocortisol
Property Insights of 6 Alpha-hydroxy(allo)tetrahydrocortisol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6 Alpha-hydroxy(allo)tetrahydrocortisol. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6 Alpha-hydroxy(allo)tetrahydrocortisol. Following Lipinski's Rule of Five, 6 Alpha-hydroxy(allo)tetrahydrocortisol has 5 hydrogen bond donor(s) and 6 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 6 Alpha-hydroxy(allo)tetrahydrocortisol?
The CAS number of 6 Alpha-hydroxy(allo)tetrahydrocortisol is 77648-51-2.
What is the molecular formula of 6 Alpha-hydroxy(allo)tetrahydrocortisol?
The molecular formula of 6 Alpha-hydroxy(allo)tetrahydrocortisol is C21H34O6.
What is the molecular weight of 6 Alpha-hydroxy(allo)tetrahydrocortisol?
The molecular weight of 6 Alpha-hydroxy(allo)tetrahydrocortisol is 382.24 g/mol.
Where can I buy 6 Alpha-hydroxy(allo)tetrahydrocortisol?
You can request a quote for 6 Alpha-hydroxy(allo)tetrahydrocortisol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6 Alpha-hydroxy(allo)tetrahydrocortisol?
Yes, KEHONG BIO provides custom synthesis services for 6 Alpha-hydroxy(allo)tetrahydrocortisol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.