Vernolide
TL;DR: Vernolide (CAS 27428-86-0) is a chemical compound with molecular formula C19H22O7 and molecular weight 362.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,3S,4R,8R,9Z,13R,15R)-15-hydroxy-5-methylidene-6-oxo-7,14,16-trioxatetracyclo[8.4.3.01,13.04,8]heptadec-9-en-3-yl] 2-methylprop-2-enoate
Also Known As: VERNOLIDE, ((1R,3S,4R,8R,9Z,13R,15R)-15-hydroxy-5-methylidene-6-oxo-7,14,16-trioxatetracyclo(8.4.3.01,13.04,8)heptadec-9-en-3-yl) 2-methylprop-2-enoate, (1R,3S,4R,8R,13R,15R)-15-hydroxy-5-methylidene-6-oxo-7,14,16-trioxatetracyclo[8.4.3.01,13.04,8]heptadec-9-en-3-yl 2-methylprop-2-enoate, 2-Methylpropenoic acid [(1aR,4Z,5aR,8aR,9S,10aR,11R)-1a,2,5a,7,8,8a,9,10-octahydro-11-hydroxy-8-methylene-7-oxo-3H-4,10a-(methanoxymethano)oxireno[5,6]cyclodeca[1,2-b]furan-9-yl] ester, RefChem:933985
| Molecular Formula | C19H22O7 |
|---|---|
| Molecular Weight | 362.14 g/mol |
| LogP | 1.1686 |
| Topological Polar Surface Area | 94.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 362.13657 |
| Heavy Atoms | 26 |
| Complexity | 723.3993 |
Chemical Identifiers
| CAS Number | 27428-86-0 |
|---|---|
| SMILES | CC(=C)C(=O)O[C@H]1C[C@]23[C@H](O2)CC/C(=C/[C@@H]4[C@@H]1C(=C)C(=O)O4)/CO[C@H]3O |
Product Overview
Vernolide (CAS 27428-86-0), with molecular formula C19H22O7 and molecular weight 362.14 g/mol. IUPAC: [(1R,3S,4R,8R,9Z,13R,15R)-15-hydroxy-5-methylidene-6-oxo-7,14,16-trioxatetracyclo[8.4.3.01,13.04,8]heptadec-9-en-3-yl] 2-methylprop-2-enoate.
Chemical Property Profile of Vernolide
Property Insights of Vernolide
The XLogP value of 1.1686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vernolide. The TPSA of 94.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Vernolide. Following Lipinski's Rule of Five, Vernolide has 1 hydrogen bond donor(s) and 7 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 Vernolide?
The CAS number of Vernolide is 27428-86-0.
What is the molecular formula of Vernolide?
The molecular formula of Vernolide is C19H22O7.
What is the molecular weight of Vernolide?
The molecular weight of Vernolide is 362.14 g/mol.
Where can I buy Vernolide?
You can request a quote for Vernolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vernolide?
Yes, KEHONG BIO provides custom synthesis services for Vernolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.