Pregomisin
TL;DR: Pregomisin (CAS 66280-26-0) is a chemical compound with molecular formula C22H30O6 and molecular weight 390.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2S,3R)-4-(3-hydroxy-4,5-dimethoxyphenyl)-2,3-dimethylbutyl]-2,3-dimethoxyphenol
Also Known As: Pregomisin, Pre-Gomisin, HY-N7343, 5-[(2S,3R)-4-(3-hydroxy-4,5-dimethoxyphenyl)-2,3-dimethylbutyl]-2,3-dimethoxyphenol, 3,3'-DIHYDROXY-4,4',5,5'-TETRAMETHOXYLIGNAN
| Molecular Formula | C22H30O6 |
|---|---|
| Molecular Weight | 390.20 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 390.20422 |
| Heavy Atoms | 28 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 66280-26-0 |
|---|---|
| SMILES | C[C@H](CC1=CC(=C(C(=C1)OC)OC)O)[C@@H](C)CC2=CC(=C(C(=C2)OC)OC)O |
| InChIKey | RLRKIWSBYUZHIJ-OKILXGFUSA-N |
Product Overview
Pregomisin (CAS 66280-26-0), with molecular formula C22H30O6 and molecular weight 390.20 g/mol. IUPAC: 5-[(2S,3R)-4-(3-hydroxy-4,5-dimethoxyphenyl)-2,3-dimethylbutyl]-2,3-dimethoxyphenol.
Chemical Property Profile of Pregomisin
Property Insights of Pregomisin
The XLogP value of 4.9 indicates that Pregomisin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Pregomisin. Following Lipinski's Rule of Five, Pregomisin has 2 hydrogen bond donor(s) and 6 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 Pregomisin?
The CAS number of Pregomisin is 66280-26-0.
What is the molecular formula of Pregomisin?
The molecular formula of Pregomisin is C22H30O6.
What is the molecular weight of Pregomisin?
The molecular weight of Pregomisin is 390.20 g/mol.
Where can I buy Pregomisin?
You can request a quote for Pregomisin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pregomisin?
Yes, KEHONG BIO provides custom synthesis services for Pregomisin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.