Chaparrolide
TL;DR: Chaparrolide (CAS 33512-38-8) is a chemical compound with molecular formula C20H30O6 and molecular weight 366.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2S,3S,4S,6R,7S,9R,13S,14R,15S,17S)-3,4,15-trihydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadecane-11,16-dione
Also Known As: Chaparrolide, 4,6,7,8-tetramethoxydibenzofuran-3-ol, 1beta,2alpha,12beta-Trihydroxypicrasane-11,16-dione, (1R,2S,3S,4S,6R,7S,9R,13S,14R,15S,17S)-3,4,15-trihydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadecane-11,16-dione
| Molecular Formula | C20H30O6 |
|---|---|
| Molecular Weight | 366.20 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 366.20422 |
| Heavy Atoms | 26 |
| Complexity | 648.0 |
Chemical Identifiers
| CAS Number | 33512-38-8 |
|---|---|
| SMILES | C[C@@H]1C[C@@H]([C@H]([C@]2([C@H]1C[C@@H]3[C@@]4([C@@H]2C(=O)[C@H]([C@@H]([C@@H]4CC(=O)O3)C)O)C)C)O)O |
| InChIKey | KBORUIMKALHADL-DXKQOFSOSA-N |
Product Overview
Chaparrolide (CAS 33512-38-8), with molecular formula C20H30O6 and molecular weight 366.20 g/mol. IUPAC: (1R,2S,3S,4S,6R,7S,9R,13S,14R,15S,17S)-3,4,15-trihydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadecane-11,16-dione.
Chemical Property Profile of Chaparrolide
Property Insights of Chaparrolide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chaparrolide. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Chaparrolide. Following Lipinski's Rule of Five, Chaparrolide has 3 hydrogen bond donor(s) and 6 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 Chaparrolide?
The CAS number of Chaparrolide is 33512-38-8.
What is the molecular formula of Chaparrolide?
The molecular formula of Chaparrolide is C20H30O6.
What is the molecular weight of Chaparrolide?
The molecular weight of Chaparrolide is 366.20 g/mol.
Where can I buy Chaparrolide?
You can request a quote for Chaparrolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chaparrolide?
Yes, KEHONG BIO provides custom synthesis services for Chaparrolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.