Stigmastane-3,6-dione
TL;DR: Stigmastane-3,6-dione (CAS 22149-69-5) is a chemical compound with molecular formula C29H48O2 and molecular weight 428.37 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-2,4,5,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,6-dione
Also Known As: Stigmastane-3,6-dione, 5alpha-Stigmastane-3,6-dione, 5alpha-Stigmastan-3,6-dione, Stigmastane-3,6-dione,(5a)-, (5alpha)-Stigmastane-3,6-dione
| Molecular Formula | C29H48O2 |
|---|---|
| Molecular Weight | 428.37 g/mol |
| LogP | 8.1 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 428.36542 |
| Heavy Atoms | 31 |
| Complexity | 695.0 |
Chemical Identifiers
| CAS Number | 22149-69-5 |
|---|---|
| SMILES | CCC(CCC(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CCC(=O)C4)C)C)C(C)C |
| InChIKey | HMMVBUVVQLUGQA-UHFFFAOYSA-N |
Product Overview
Stigmastane-3,6-dione (CAS 22149-69-5), with molecular formula C29H48O2 and molecular weight 428.37 g/mol. IUPAC: 17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,4,5,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,6-dione.
Chemical Property Profile of Stigmastane-3,6-dione
Property Insights of Stigmastane-3,6-dione
The XLogP value of 8.1 indicates that Stigmastane-3,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, Stigmastane-3,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Stigmastane-3,6-dione has 0 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 Stigmastane-3,6-dione?
The CAS number of Stigmastane-3,6-dione is 22149-69-5.
What is the molecular formula of Stigmastane-3,6-dione?
The molecular formula of Stigmastane-3,6-dione is C29H48O2.
What is the molecular weight of Stigmastane-3,6-dione?
The molecular weight of Stigmastane-3,6-dione is 428.37 g/mol.
Where can I buy Stigmastane-3,6-dione?
You can request a quote for Stigmastane-3,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stigmastane-3,6-dione?
Yes, KEHONG BIO provides custom synthesis services for Stigmastane-3,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.