Dehydropachyrrhizone
TL;DR: Dehydropachyrrhizone (CAS 28607-94-5) is a chemical compound with molecular formula C20H12O7 and molecular weight 364.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-methoxy-5,7,11,14,18-pentaoxahexacyclo[11.11.0.02,10.04,8.015,23.017,21]tetracosa-1(13),2,4(8),9,15(23),16,19,21-octaen-24-one
Also Known As: Dehydropachyrrhizone, Spectrum3_001391, Spectrum4_001989, 6a,13a-Didehydropachyrrhizone, KBio3_002222
| Molecular Formula | C20H12O7 |
|---|---|
| Molecular Weight | 364.06 g/mol |
| LogP | 3.8359 |
| Topological Polar Surface Area | 80.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 364.0583 |
| Heavy Atoms | 27 |
| Complexity | 1311.8926 |
Chemical Identifiers
| CAS Number | 28607-94-5 |
|---|---|
| SMILES | COC1=C2C(=CC3=C1OC4=C(C3=O)C5=CC6=C(C=C5OC4)OCO6)C=CO2 |
Product Overview
Dehydropachyrrhizone (CAS 28607-94-5), with molecular formula C20H12O7 and molecular weight 364.06 g/mol. IUPAC: 16-methoxy-5,7,11,14,18-pentaoxahexacyclo[11.11.0.02,10.04,8.015,23.017,21]tetracosa-1(13),2,4(8),9,15(23),16,19,21-octaen-24-one.
Chemical Property Profile of Dehydropachyrrhizone
Property Insights of Dehydropachyrrhizone
The XLogP value of 3.8359 indicates that Dehydropachyrrhizone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.27 Ų falls within the moderate polarity range, balancing permeability and solubility for Dehydropachyrrhizone. Following Lipinski's Rule of Five, Dehydropachyrrhizone has 0 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 Dehydropachyrrhizone?
The CAS number of Dehydropachyrrhizone is 28607-94-5.
What is the molecular formula of Dehydropachyrrhizone?
The molecular formula of Dehydropachyrrhizone is C20H12O7.
What is the molecular weight of Dehydropachyrrhizone?
The molecular weight of Dehydropachyrrhizone is 364.06 g/mol.
Where can I buy Dehydropachyrrhizone?
You can request a quote for Dehydropachyrrhizone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dehydropachyrrhizone?
Yes, KEHONG BIO provides custom synthesis services for Dehydropachyrrhizone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.