Acaterin
TL;DR: Acaterin (CAS 144398-20-9) is a chemical compound with molecular formula C13H22O3 and molecular weight 226.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-4-[(1R)-1-hydroxyoctyl]-2-methyl-2H-furan-5-one
Also Known As: Acaterin, (+)-Acaterin, (-)-Acaterin, 3-(1-Hydroxyoctyl)-5-methyl-2(5H)-furanone, 2(5H)-Furanone, 3-(1-hydroxyoctyl)-5-methyl-
| Molecular Formula | C13H22O3 |
|---|---|
| Molecular Weight | 226.16 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 226.15689 |
| Heavy Atoms | 16 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 144398-20-9 |
|---|---|
| SMILES | CCCCCCC[C@H](C1=C[C@H](OC1=O)C)O |
| InChIKey | YUMHJXLSSASJGN-ZYHUDNBSSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acaterin (CAS 144398-20-9), with molecular formula C13H22O3 and molecular weight 226.16 g/mol. IUPAC: (2R)-4-[(1R)-1-hydroxyoctyl]-2-methyl-2H-furan-5-one.
Chemical Property Profile of Acaterin
Property Insights of Acaterin
The XLogP value of 3.7 indicates that Acaterin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Acaterin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acaterin has 1 hydrogen bond donor(s) and 3 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 Acaterin?
The CAS number of Acaterin is 144398-20-9.
What is the molecular formula of Acaterin?
The molecular formula of Acaterin is C13H22O3.
What is the molecular weight of Acaterin?
The molecular weight of Acaterin is 226.16 g/mol.
Where can I buy Acaterin?
You can request a quote for Acaterin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acaterin?
Yes, KEHONG BIO provides custom synthesis services for Acaterin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.