KST-1A7613
TL;DR: KST-1A7613 (CAS 69269-55-2) is a chemical compound with molecular formula C21H28O3 and molecular weight 328.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2S,5S,9S,10R,13S,15S)-5-methyl-6-oxo-15-pentacyclo[11.4.1.01,13.02,10.05,9]octadec-11-enyl] acetate
Also Known As: KST-1A7613, (3, A,5, A)-17-oxo-5,19-cycloandrost-6-en-3-yl acetate, [(1S,2S,5S,9S,10R,13S,15S)-5-methyl-6-oxo-15-pentacyclo[11.4.1.01,13.02,10.05,9]octadec-11-enyl] acetate
| Molecular Formula | C21H28O3 |
|---|---|
| Molecular Weight | 328.20 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.20386 |
| Heavy Atoms | 24 |
| Complexity | 651.0 |
Chemical Identifiers
| CAS Number | 69269-55-2 |
|---|---|
| SMILES | CC(=O)O[C@H]1CC[C@@]23C[C@]2(C1)C=C[C@@H]4[C@@H]3CC[C@]5([C@H]4CCC5=O)C |
| InChIKey | FUGNGPAKVKQMRY-FPYHTYPQSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
KST-1A7613 (CAS 69269-55-2), with molecular formula C21H28O3 and molecular weight 328.20 g/mol. IUPAC: [(1S,2S,5S,9S,10R,13S,15S)-5-methyl-6-oxo-15-pentacyclo[11.4.1.01,13.02,10.05,9]octadec-11-enyl] acetate.
Chemical Property Profile of KST-1A7613
Property Insights of KST-1A7613
The XLogP value of 3.6 indicates that KST-1A7613 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, KST-1A7613 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1A7613 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1A7613?
The CAS number of KST-1A7613 is 69269-55-2.
What is the molecular formula of KST-1A7613?
The molecular formula of KST-1A7613 is C21H28O3.
What is the molecular weight of KST-1A7613?
The molecular weight of KST-1A7613 is 328.20 g/mol.
Where can I buy KST-1A7613?
You can request a quote for KST-1A7613 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A7613?
Yes, KEHONG BIO provides custom synthesis services for KST-1A7613 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.