Stigmast-4-en-3-one
TL;DR: Stigmast-4-en-3-one (CAS 67392-96-5) is a chemical compound with molecular formula C29H48O and molecular weight 412.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: Sitostenone, Stigmast-4-en-3-one, beta-sitostenone, A-Sitostenone, Stigmastenone
| Molecular Formula | C29H48O |
|---|---|
| Molecular Weight | 412.37 g/mol |
| LogP | 8.233 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.3705 |
| Heavy Atoms | 30 |
| Complexity | 673.8511 |
Chemical Identifiers
| CAS Number | 67392-96-5 |
|---|---|
| SMILES | CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)C(C)C |
Product Overview
Stigmast-4-en-3-one (CAS 67392-96-5), with molecular formula C29H48O and molecular weight 412.37 g/mol. IUPAC: (8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of Stigmast-4-en-3-one
Property Insights of Stigmast-4-en-3-one
The XLogP value of 8.233 indicates that Stigmast-4-en-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, Stigmast-4-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Stigmast-4-en-3-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Stigmast-4-en-3-one?
The CAS number of Stigmast-4-en-3-one is 67392-96-5.
What is the molecular formula of Stigmast-4-en-3-one?
The molecular formula of Stigmast-4-en-3-one is C29H48O.
What is the molecular weight of Stigmast-4-en-3-one?
The molecular weight of Stigmast-4-en-3-one is 412.37 g/mol.
Where can I buy Stigmast-4-en-3-one?
You can request a quote for Stigmast-4-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stigmast-4-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for Stigmast-4-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.