Stigmastenone
TL;DR: Stigmastenone (CAS 4736-55-4) 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.
(5R,8R,9S,10S,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
Also Known As: Stigmastenone, STIGMASTEROL, 5beta-Stigmast-22-en-3-one, (5beta,22E)-Stigmast-22-en-3-one, Stigmast-22-en-3-one, (5beta,22E)-
| Molecular Formula | C29H48O |
|---|---|
| Molecular Weight | 412.37 g/mol |
| LogP | 8.0889 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.3705 |
| Heavy Atoms | 30 |
| Complexity | 661.2747 |
Chemical Identifiers
| CAS Number | 4736-55-4 |
|---|---|
| SMILES | CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CCC(=O)C4)C)C)C(C)C |
Product Overview
Stigmastenone (CAS 4736-55-4), with molecular formula C29H48O and molecular weight 412.37 g/mol. IUPAC: (5R,8R,9S,10S,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of Stigmastenone
Property Insights of Stigmastenone
The XLogP value of 8.0889 indicates that Stigmastenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, Stigmastenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Stigmastenone 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 Stigmastenone?
The CAS number of Stigmastenone is 4736-55-4.
What is the molecular formula of Stigmastenone?
The molecular formula of Stigmastenone is C29H48O.
What is the molecular weight of Stigmastenone?
The molecular weight of Stigmastenone is 412.37 g/mol.
Where can I buy Stigmastenone?
You can request a quote for Stigmastenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stigmastenone?
Yes, KEHONG BIO provides custom synthesis services for Stigmastenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.