delta14,15-Chaparrinone
TL;DR: delta14,15-Chaparrinone (CAS 79752-58-2) is a chemical compound with molecular formula C20H24O7 and molecular weight 376.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,17-trihydroxy-6,14,18-trimethyl-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadeca-7,14-diene-9,16-dione
Also Known As: delta14,15-Chaparrinone, .DELTA.14,15-Chaparrinone, CHAPARRINONE,15-DEHYDRO-, 1,11,12-Trihydroxy-11,20-epoxypicrasa-3,14-diene-2,16-dione
| Molecular Formula | C20H24O7 |
|---|---|
| Molecular Weight | 376.15 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 376.1522 |
| Heavy Atoms | 27 |
| Complexity | 830.0 |
Chemical Identifiers
| CAS Number | 79752-58-2 |
|---|---|
| SMILES | CC1C(C2(C3C4(C(CC5C3(C1=CC(=O)O5)CO2)C(=CC(=O)C4O)C)C)O)O |
| InChIKey | WSMBJDADLKPENB-UHFFFAOYSA-N |
Product Overview
delta14,15-Chaparrinone (CAS 79752-58-2), with molecular formula C20H24O7 and molecular weight 376.15 g/mol. IUPAC: 4,5,17-trihydroxy-6,14,18-trimethyl-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadeca-7,14-diene-9,16-dione.
Chemical Property Profile of delta14,15-Chaparrinone
Property Insights of delta14,15-Chaparrinone
The XLogP value of -0.7 indicates that delta14,15-Chaparrinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for delta14,15-Chaparrinone. Following Lipinski's Rule of Five, delta14,15-Chaparrinone has 3 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 delta14,15-Chaparrinone?
The CAS number of delta14,15-Chaparrinone is 79752-58-2.
What is the molecular formula of delta14,15-Chaparrinone?
The molecular formula of delta14,15-Chaparrinone is C20H24O7.
What is the molecular weight of delta14,15-Chaparrinone?
The molecular weight of delta14,15-Chaparrinone is 376.15 g/mol.
Where can I buy delta14,15-Chaparrinone?
You can request a quote for delta14,15-Chaparrinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for delta14,15-Chaparrinone?
Yes, KEHONG BIO provides custom synthesis services for delta14,15-Chaparrinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.