Ketopelenolide A
TL;DR: Ketopelenolide A (CAS 17909-92-1) is a chemical compound with molecular formula C15H22O3 and molecular weight 250.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,3aS,6Z,10S,11aR)-3,6,10-trimethyl-3,3a,4,5,8,10,11,11a-octahydrocyclodeca[b]furan-2,9-dione
Also Known As: Ketopelenolid-A, Ketopelenolide A, Oxopelenolide a, Ketopelenolid A, (3R,3aS,6Z,10S,11aR)-3,6,10-trimethyl-3,3a,4,5,8,10,11,11a-octahydrocyclodeca[b]furan-2,9-dione
| Molecular Formula | C15H22O3 |
|---|---|
| Molecular Weight | 250.16 g/mol |
| LogP | 2.8896 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 250.15689 |
| Heavy Atoms | 18 |
| Complexity | 383.19995 |
Chemical Identifiers
| CAS Number | 17909-92-1 |
|---|---|
| SMILES | C[C@H]1C[C@@H]2[C@@H](CC/C(=C\CC1=O)/C)[C@H](C(=O)O2)C |
Product Overview
Ketopelenolide A (CAS 17909-92-1), with molecular formula C15H22O3 and molecular weight 250.16 g/mol. IUPAC: (3R,3aS,6Z,10S,11aR)-3,6,10-trimethyl-3,3a,4,5,8,10,11,11a-octahydrocyclodeca[b]furan-2,9-dione.
Chemical Property Profile of Ketopelenolide A
Property Insights of Ketopelenolide A
The XLogP value of 2.8896 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ketopelenolide A. With a topological polar surface area (TPSA) of 43.37 Ų, Ketopelenolide A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketopelenolide A 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 Ketopelenolide A?
The CAS number of Ketopelenolide A is 17909-92-1.
What is the molecular formula of Ketopelenolide A?
The molecular formula of Ketopelenolide A is C15H22O3.
What is the molecular weight of Ketopelenolide A?
The molecular weight of Ketopelenolide A is 250.16 g/mol.
Where can I buy Ketopelenolide A?
You can request a quote for Ketopelenolide A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ketopelenolide A?
Yes, KEHONG BIO provides custom synthesis services for Ketopelenolide A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.