Xestoquinone
TL;DR: Xestoquinone (CAS 97743-96-9) is a chemical compound with molecular formula C20H14O4 and molecular weight 318.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S)-1-methyl-14-oxapentacyclo[11.6.1.02,11.04,9.016,20]icosa-2(11),3,6,9,13(20),15-hexaene-5,8,12-trione
Also Known As: Xestoquinone, (+)-Xestoquinone, Xestoquinone;, 1-XQN, XESTOQUINONE, (+)-
| Molecular Formula | C20H14O4 |
|---|---|
| Molecular Weight | 318.09 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 318.0892 |
| Heavy Atoms | 24 |
| Complexity | 665.0 |
Chemical Identifiers
| CAS Number | 97743-96-9 |
|---|---|
| SMILES | C[C@@]12CCCC3=COC(=C31)C(=O)C4=C2C=C5C(=O)C=CC(=O)C5=C4 |
| InChIKey | HDONDRKCXFRHQQ-FQEVSTJZSA-N |
Product Overview
Xestoquinone (CAS 97743-96-9), with molecular formula C20H14O4 and molecular weight 318.09 g/mol. IUPAC: (1S)-1-methyl-14-oxapentacyclo[11.6.1.02,11.04,9.016,20]icosa-2(11),3,6,9,13(20),15-hexaene-5,8,12-trione.
Chemical Property Profile of Xestoquinone
Property Insights of Xestoquinone
The XLogP value of 3.7 indicates that Xestoquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Xestoquinone. Following Lipinski's Rule of Five, Xestoquinone 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 Xestoquinone?
The CAS number of Xestoquinone is 97743-96-9.
What is the molecular formula of Xestoquinone?
The molecular formula of Xestoquinone is C20H14O4.
What is the molecular weight of Xestoquinone?
The molecular weight of Xestoquinone is 318.09 g/mol.
Where can I buy Xestoquinone?
You can request a quote for Xestoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xestoquinone?
Yes, KEHONG BIO provides custom synthesis services for Xestoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.