8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid
TL;DR: 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid (CAS 128885-13-2) is a chemical compound with molecular formula C16H25NO12 and molecular weight 423.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,5R,6R,7S,8R)-7,9-diacetyloxy-4,6-dihydroxy-5-[(2-hydroxyacetyl)amino]-8-methoxy-2-oxononanoic acid
Also Known As: MAFN, 8-O-Me-7,9-di-O-Nac-gcneu, 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid, 7,9-Di-O-acetyl-N-glycolyl-8-O-methylneuraminic acid, (4S,5R,6R,7S,8R)-7,9-diacetyloxy-4,6-dihydroxy-5-[(2-hydroxyacetyl)amino]-8-methoxy-2-oxononanoic acid
| Molecular Formula | C16H25NO12 |
|---|---|
| Molecular Weight | 423.14 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 206.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 15 |
| Exact Mass | 423.13766 |
| Heavy Atoms | 29 |
| Complexity | 607.0 |
Chemical Identifiers
| CAS Number | 128885-13-2 |
|---|---|
| SMILES | CC(=O)OC[C@H]([C@H]([C@@H]([C@@H]([C@H](CC(=O)C(=O)O)O)NC(=O)CO)O)OC(=O)C)OC |
| InChIKey | MZSWGZQPIQDMAD-RDXHHOOHSA-N |
Product Overview
8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid (CAS 128885-13-2), with molecular formula C16H25NO12 and molecular weight 423.14 g/mol. IUPAC: (4S,5R,6R,7S,8R)-7,9-diacetyloxy-4,6-dihydroxy-5-[(2-hydroxyacetyl)amino]-8-methoxy-2-oxononanoic acid.
Chemical Property Profile of 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid
Property Insights of 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid
The XLogP value of -3.1 indicates that 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 206.0 Ų indicates high polarity, suggesting 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid?
The CAS number of 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid is 128885-13-2.
What is the molecular formula of 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid?
The molecular formula of 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid is C16H25NO12.
What is the molecular weight of 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid?
The molecular weight of 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid is 423.14 g/mol.
Where can I buy 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid?
You can request a quote for 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid?
Yes, KEHONG BIO provides custom synthesis services for 8-O-Methyl-7,9-di-O-acetyl-N-glycolylneuraminic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.