2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid
TL;DR: 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid (CAS 59322-44-0) is a chemical compound with molecular formula C21H25NO11 and molecular weight 467.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,4S,5R,6R)-5-acetamido-4-hydroxy-2-(4-methyl-2-oxochromen-7-yl)oxy-6-[(2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
Also Known As: MUNANA compound, 4MU-Nana, 4-Methylumbelliferyl NANA, 2-(Trimethylsilylmethyl)thiophene, KST-1A6486
| Molecular Formula | C21H25NO11 |
|---|---|
| Molecular Weight | 467.14 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 467.14276 |
| Heavy Atoms | 33 |
| Complexity | 801.0 |
Chemical Identifiers
| CAS Number | 59322-44-0 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)O[C@@]3(C[C@@H]([C@H]([C@@H](O3)C([C@@H](CO)O)O)NC(=O)C)O)C(=O)O |
| InChIKey | KKDWIUJBUSOPGC-KPPVFQKOSA-N |
Product Overview
2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid (CAS 59322-44-0), with molecular formula C21H25NO11 and molecular weight 467.14 g/mol. IUPAC: (2S,4S,5R,6R)-5-acetamido-4-hydroxy-2-(4-methyl-2-oxochromen-7-yl)oxy-6-[(2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid.
Chemical Property Profile of 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid
Property Insights of 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid
The XLogP value of -1.2 indicates that 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 192.0 Ų indicates high polarity, suggesting 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid?
The CAS number of 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid is 59322-44-0.
What is the molecular formula of 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid?
The molecular formula of 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid is C21H25NO11.
What is the molecular weight of 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid?
The molecular weight of 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid is 467.14 g/mol.
Where can I buy 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid?
You can request a quote for 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid?
Yes, KEHONG BIO provides custom synthesis services for 2'-(4-Methylumbelliferyl)-alpha-D-N-acetylneuraminic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.