Luteorosin
TL;DR: Luteorosin (CAS 128201-22-9) is a chemical compound with molecular formula C21H26O5 and molecular weight 358.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[7-acetyl-6-[(3,3-dimethylcyclohexyl)methyl]-3-oxo-1H-2-benzofuran-1-yl] acetate
Also Known As: Luteorosin, [7-acetyl-6-[(3,3-dimethylcyclohexyl)methyl]-3-oxo-1H-2-benzofuran-1-yl] acetate, 1(3H)-Isobenzofuranone, 4-acetyl-3-(acetyloxy)-5-((3,3-dimethylcyclohexyl)methyl)-, ((1S)-7-acetyl-6-((3,3-dimethylcyclohexyl)methyl)-3-oxo-1H-2-benzofuran-1-yl) acetate, (7-acetyl-6-((3,3-dimethylcyclohexyl)methyl)-3-oxo-1H-2-benzofuran-1-yl) acetate
| Molecular Formula | C21H26O5 |
|---|---|
| Molecular Weight | 358.18 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.178 |
| Heavy Atoms | 26 |
| Complexity | 581.0 |
Chemical Identifiers
| CAS Number | 128201-22-9 |
|---|---|
| SMILES | CC(=O)C1=C(C=CC2=C1C(OC2=O)OC(=O)C)CC3CCCC(C3)(C)C |
| InChIKey | RGZDSRRDRQIAFS-UHFFFAOYSA-N |
Product Overview
Luteorosin (CAS 128201-22-9), with molecular formula C21H26O5 and molecular weight 358.18 g/mol. IUPAC: [7-acetyl-6-[(3,3-dimethylcyclohexyl)methyl]-3-oxo-1H-2-benzofuran-1-yl] acetate.
Chemical Property Profile of Luteorosin
Property Insights of Luteorosin
The XLogP value of 4.7 indicates that Luteorosin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Luteorosin. Following Lipinski's Rule of Five, Luteorosin has 0 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 Luteorosin?
The CAS number of Luteorosin is 128201-22-9.
What is the molecular formula of Luteorosin?
The molecular formula of Luteorosin is C21H26O5.
What is the molecular weight of Luteorosin?
The molecular weight of Luteorosin is 358.18 g/mol.
Where can I buy Luteorosin?
You can request a quote for Luteorosin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Luteorosin?
Yes, KEHONG BIO provides custom synthesis services for Luteorosin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.