1,6-Anhydromuramic acid
TL;DR: 1,6-Anhydromuramic acid (CAS 82080-93-1) is a chemical compound with molecular formula C9H15NO6 and molecular weight 233.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[[(1S,2S,3R,4R,5S)-4-amino-2-hydroxy-6,8-dioxabicyclo[3.2.1]octan-3-yl]oxy]propanoic acid
Also Known As: 1,6-Anhydromuramic acid, (2R)-2-[[(1S,2S,3R,4R,5S)-4-amino-2-hydroxy-6,8-dioxabicyclo[3.2.1]octan-3-yl]oxy]propanoic acid, beta-D-Glucopyranose, 2-amino-1,6-anhydro-3-O-(1-carboxyethyl)-2-deoxy-, (R)-, RefChem:73570
| Molecular Formula | C9H15NO6 |
|---|---|
| Molecular Weight | 233.09 g/mol |
| LogP | -1.712 |
| Topological Polar Surface Area | 111.24 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.08994 |
| Heavy Atoms | 16 |
| Complexity | 269.1728 |
Chemical Identifiers
| CAS Number | 82080-93-1 |
|---|---|
| SMILES | C[C@H](C(=O)O)O[C@@H]1[C@H]([C@H]2OC[C@@H]([C@H]1O)O2)N |
Product Overview
1,6-Anhydromuramic acid (CAS 82080-93-1), with molecular formula C9H15NO6 and molecular weight 233.09 g/mol. IUPAC: (2R)-2-[[(1S,2S,3R,4R,5S)-4-amino-2-hydroxy-6,8-dioxabicyclo[3.2.1]octan-3-yl]oxy]propanoic acid.
Chemical Property Profile of 1,6-Anhydromuramic acid
Property Insights of 1,6-Anhydromuramic acid
The XLogP value of -1.712 indicates that 1,6-Anhydromuramic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,6-Anhydromuramic acid. Following Lipinski's Rule of Five, 1,6-Anhydromuramic acid has 3 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 1,6-Anhydromuramic acid?
The CAS number of 1,6-Anhydromuramic acid is 82080-93-1.
What is the molecular formula of 1,6-Anhydromuramic acid?
The molecular formula of 1,6-Anhydromuramic acid is C9H15NO6.
What is the molecular weight of 1,6-Anhydromuramic acid?
The molecular weight of 1,6-Anhydromuramic acid is 233.09 g/mol.
Where can I buy 1,6-Anhydromuramic acid?
You can request a quote for 1,6-Anhydromuramic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Anhydromuramic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Anhydromuramic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.