Ergostane-3,15-diol
TL;DR: Ergostane-3,15-diol (CAS 126291-46-1) is a chemical compound with molecular formula C28H50O2 and molecular weight 418.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5S,8R,9S,10S,13R,14S,15S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,15-diol
Also Known As: Ergostane-3,15-diol, 5alpha-Ergostane-3beta,15alpha-diol, 5alpha,14beta-Ergostane-3beta,15beta-diol, 5 alpha-ergostane-3 beta,15 alpha-diol, Ergostane-3,15-diol, (3b,5a,15a)- (9CI)
| Molecular Formula | C28H50O2 |
|---|---|
| Molecular Weight | 418.38 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.38107 |
| Heavy Atoms | 30 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 126291-46-1 |
|---|---|
| SMILES | C[C@H](CC[C@H](C)C(C)C)[C@H]1C[C@@H]([C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)O |
| InChIKey | VMNBOLDGMBVGNQ-NAZNOAFGSA-N |
Product Overview
Ergostane-3,15-diol (CAS 126291-46-1), with molecular formula C28H50O2 and molecular weight 418.38 g/mol. IUPAC: (3S,5S,8R,9S,10S,13R,14S,15S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,15-diol.
Chemical Property Profile of Ergostane-3,15-diol
Property Insights of Ergostane-3,15-diol
The XLogP value of 8.3 indicates that Ergostane-3,15-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, Ergostane-3,15-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ergostane-3,15-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ergostane-3,15-diol?
The CAS number of Ergostane-3,15-diol is 126291-46-1.
What is the molecular formula of Ergostane-3,15-diol?
The molecular formula of Ergostane-3,15-diol is C28H50O2.
What is the molecular weight of Ergostane-3,15-diol?
The molecular weight of Ergostane-3,15-diol is 418.38 g/mol.
Where can I buy Ergostane-3,15-diol?
You can request a quote for Ergostane-3,15-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ergostane-3,15-diol?
Yes, KEHONG BIO provides custom synthesis services for Ergostane-3,15-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.