Khellactone, cis-(+)-
TL;DR: Khellactone, cis-(+)- (CAS 15645-11-1) is a chemical compound with molecular formula C14H14O5 and molecular weight 262.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9R,10R)-9,10-dihydroxy-8,8-dimethyl-9,10-dihydropyrano[2,3-f]chromen-2-one
Also Known As: (+)-cis-Khellactone, Khellactone, cis-Khellactone, Visnagan, Visnadin
| Molecular Formula | C14H14O5 |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 262.08414 |
| Heavy Atoms | 19 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 15645-11-1 |
|---|---|
| SMILES | CC1([C@@H]([C@@H](C2=C(O1)C=CC3=C2OC(=O)C=C3)O)O)C |
| InChIKey | HKXQUNNSKMWIKJ-DGCLKSJQSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Khellactone, cis-(+)- (CAS 15645-11-1), with molecular formula C14H14O5 and molecular weight 262.08 g/mol. IUPAC: (9R,10R)-9,10-dihydroxy-8,8-dimethyl-9,10-dihydropyrano[2,3-f]chromen-2-one.
Chemical Property Profile of Khellactone, cis-(+)-
Property Insights of Khellactone, cis-(+)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Khellactone, cis-(+)-. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Khellactone, cis-(+)-. Following Lipinski's Rule of Five, Khellactone, cis-(+)- has 2 hydrogen bond donor(s) and 5 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 Khellactone, cis-(+)-?
The CAS number of Khellactone, cis-(+)- is 15645-11-1.
What is the molecular formula of Khellactone, cis-(+)-?
The molecular formula of Khellactone, cis-(+)- is C14H14O5.
What is the molecular weight of Khellactone, cis-(+)-?
The molecular weight of Khellactone, cis-(+)- is 262.08 g/mol.
Where can I buy Khellactone, cis-(+)-?
You can request a quote for Khellactone, cis-(+)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Khellactone, cis-(+)-?
Yes, KEHONG BIO provides custom synthesis services for Khellactone, cis-(+)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.