Vernoflexin
TL;DR: Vernoflexin (CAS 57576-43-9) is a chemical compound with molecular formula C20H24O4 and molecular weight 328.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3aS,6aR,8S,9aR,9bS)-3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-8-yl] 3-methylbut-2-enoate
Also Known As: Vernoflexin, [(3aS,6aR,8S,9aR,9bS)-3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-8-yl] 3-methylbut-2-enoate, ((3aS,6aR,8S,9aR,9bS)-3,6,9-trimethylene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno(4,5-b)furan-8-yl) 3-methylbut-2-enoate, ((3aS,6aS,8S,9aR,9bS)-3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno(4,5-b)furan-8-yl) 3-methylbut-2-enoate, (3aS,6aR,8S,9aR,9bS)-3,6,9-trimethylidene-2-oxo-dodecahydroazuleno[4,5-b]furan-8-yl 3-methylbut-2-enoate
| Molecular Formula | C20H24O4 |
|---|---|
| Molecular Weight | 328.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.16745 |
| Heavy Atoms | 24 |
| Complexity | 665.0 |
Chemical Identifiers
| CAS Number | 57576-43-9 |
|---|---|
| SMILES | CC(=CC(=O)O[C@H]1C[C@@H]2[C@H](C1=C)[C@@H]3[C@@H](CCC2=C)C(=C)C(=O)O3)C |
| InChIKey | CEKDWOBPPFOCDL-QAGGRKNESA-N |
Product Overview
Vernoflexin (CAS 57576-43-9), with molecular formula C20H24O4 and molecular weight 328.17 g/mol. IUPAC: [(3aS,6aR,8S,9aR,9bS)-3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-8-yl] 3-methylbut-2-enoate.
Chemical Property Profile of Vernoflexin
Property Insights of Vernoflexin
The XLogP value of 3.3 indicates that Vernoflexin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Vernoflexin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vernoflexin has 0 hydrogen bond donor(s) and 4 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 Vernoflexin?
The CAS number of Vernoflexin is 57576-43-9.
What is the molecular formula of Vernoflexin?
The molecular formula of Vernoflexin is C20H24O4.
What is the molecular weight of Vernoflexin?
The molecular weight of Vernoflexin is 328.17 g/mol.
Where can I buy Vernoflexin?
You can request a quote for Vernoflexin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vernoflexin?
Yes, KEHONG BIO provides custom synthesis services for Vernoflexin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.