5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol
TL;DR: 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol (CAS 84965-66-2) is a chemical compound with molecular formula C28H50O4 and molecular weight 450.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5R,6R,7R,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,6,7-tetrol
Also Known As: 5-EG-TO, 5alpha-Ergostane-3beta,5,6beta,7beta-tetrol, ergostane-3,5,6,7-tetrol, A-ergostane-3, A,5,6
| Molecular Formula | C28H50O4 |
|---|---|
| Molecular Weight | 450.37 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 450.3709 |
| Heavy Atoms | 32 |
| Complexity | 680.0 |
Chemical Identifiers
| CAS Number | 84965-66-2 |
|---|---|
| SMILES | C[C@H](CC[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H]([C@H]([C@@]4([C@@]3(CC[C@@H](C4)O)C)O)O)O)C |
| InChIKey | XMPORRMUVWJINB-AQESZVELSA-N |
Product Overview
5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol (CAS 84965-66-2), with molecular formula C28H50O4 and molecular weight 450.37 g/mol. IUPAC: (3S,5R,6R,7R,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,6,7-tetrol.
Chemical Property Profile of 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol
Property Insights of 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol
The XLogP value of 6.2 indicates that 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol. Following Lipinski's Rule of Five, 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol?
The CAS number of 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol is 84965-66-2.
What is the molecular formula of 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol?
The molecular formula of 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol is C28H50O4.
What is the molecular weight of 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol?
The molecular weight of 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol is 450.37 g/mol.
Where can I buy 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol?
You can request a quote for 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol?
Yes, KEHONG BIO provides custom synthesis services for 5 Alpha-ergostane-3 beta,5,6 beta,7 beta-tetrol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.