sorgoleone
TL;DR: sorgoleone (CAS 105018-76-6) is a chemical compound with molecular formula C22H30O4 and molecular weight 358.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-3-[(4Z,7Z,12E)-11-methoxypentadeca-4,7,12-trien-2-yl]cyclohexa-2,5-diene-1,4-dione
Also Known As: sorgoleone, (Z,Z)-2-Hydroxy-5-methoxy-3-(8,11,14-pentadecatrienyl)-2,5-cyclohexadiene-1,4-dione, 2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-(8Z,11Z)-8,11,14-pentadecatrienyl-, 2-hydroxy-3-[(4Z,7Z,12E)-11-methoxypentadeca-4,7,12-trien-2-yl]cyclohexa-2,5-diene-1,4-dione
| Molecular Formula | C22H30O4 |
|---|---|
| Molecular Weight | 358.21 g/mol |
| LogP | 4.7966 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 358.21442 |
| Heavy Atoms | 26 |
| Complexity | 620.0535 |
Chemical Identifiers
| CAS Number | 105018-76-6 |
|---|---|
| SMILES | CC/C=C/C(CC/C=C\C/C=C\CC(C)C1=C(C(=O)C=CC1=O)O)OC |
Product Overview
sorgoleone (CAS 105018-76-6), with molecular formula C22H30O4 and molecular weight 358.21 g/mol. IUPAC: 2-hydroxy-3-[(4Z,7Z,12E)-11-methoxypentadeca-4,7,12-trien-2-yl]cyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of sorgoleone
Property Insights of sorgoleone
The XLogP value of 4.7966 indicates that sorgoleone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for sorgoleone. Following Lipinski's Rule of Five, sorgoleone has 1 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 sorgoleone?
The CAS number of sorgoleone is 105018-76-6.
What is the molecular formula of sorgoleone?
The molecular formula of sorgoleone is C22H30O4.
What is the molecular weight of sorgoleone?
The molecular weight of sorgoleone is 358.21 g/mol.
Where can I buy sorgoleone?
You can request a quote for sorgoleone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for sorgoleone?
Yes, KEHONG BIO provides custom synthesis services for sorgoleone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.