5alpha-Stigmastane
TL;DR: 5alpha-Stigmastane (CAS 71117-92-5) is a chemical compound with molecular formula C29H52 and molecular weight 400.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
Also Known As: Stigmastane, 5beta-stigmastane, C29-steroid, a C29-steroid, 5.alpha.-Stigmastane
| Molecular Formula | C29H52 |
|---|---|
| Molecular Weight | 400.41 g/mol |
| LogP | 11.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.4069 |
| Heavy Atoms | 29 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 71117-92-5 |
|---|---|
| SMILES | CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C)C(C)C |
| InChIKey | GKBHKNPLNHLYHT-UHFFFAOYSA-N |
Product Overview
5alpha-Stigmastane (CAS 71117-92-5), with molecular formula C29H52 and molecular weight 400.41 g/mol. IUPAC: 17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene.
Chemical Property Profile of 5alpha-Stigmastane
Property Insights of 5alpha-Stigmastane
The XLogP value of 11.9 indicates that 5alpha-Stigmastane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 5alpha-Stigmastane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5alpha-Stigmastane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5alpha-Stigmastane?
The CAS number of 5alpha-Stigmastane is 71117-92-5.
What is the molecular formula of 5alpha-Stigmastane?
The molecular formula of 5alpha-Stigmastane is C29H52.
What is the molecular weight of 5alpha-Stigmastane?
The molecular weight of 5alpha-Stigmastane is 400.41 g/mol.
Where can I buy 5alpha-Stigmastane?
You can request a quote for 5alpha-Stigmastane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5alpha-Stigmastane?
Yes, KEHONG BIO provides custom synthesis services for 5alpha-Stigmastane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.