N-acetyl-9-O-lactylneuraminic acid
TL;DR: N-acetyl-9-O-lactylneuraminic acid (CAS 65167-52-4) is a chemical compound with molecular formula C14H23NO11 and molecular weight 381.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4S,5R,6R)-5-acetamido-6-[(1R,2R)-1,2-dihydroxy-3-[(2S)-2-hydroxypropanoyl]oxypropyl]-2,4-dihydroxyoxane-2-carboxylic acid
Also Known As: Neu5Ac9Lt, 9-O-Lactyl-N-acetylneuraminic acid, N-Acetyl-9-O-lactylneuraminic acid, N-Acetyl-9-O-L-lactylneuraminic acid, (2R,4S,5R,6R)-5-acetamido-6-[(1R,2R)-1,2-dihydroxy-3-[(2S)-2-hydroxypropanoyl]oxypropyl]-2,4-dihydroxyoxane-2-carboxylic acid
| Molecular Formula | C14H23NO11 |
|---|---|
| Molecular Weight | 381.13 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 203.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 381.1271 |
| Heavy Atoms | 26 |
| Complexity | 541.0 |
Chemical Identifiers
| CAS Number | 65167-52-4 |
|---|---|
| SMILES | C[C@@H](C(=O)OC[C@H]([C@H]([C@H]1[C@@H]([C@H](C[C@@](O1)(C(=O)O)O)O)NC(=O)C)O)O)O |
| InChIKey | XXNWSGSWDRDYLR-ITLAUYTFSA-N |
Product Overview
N-acetyl-9-O-lactylneuraminic acid (CAS 65167-52-4), with molecular formula C14H23NO11 and molecular weight 381.13 g/mol. IUPAC: (2R,4S,5R,6R)-5-acetamido-6-[(1R,2R)-1,2-dihydroxy-3-[(2S)-2-hydroxypropanoyl]oxypropyl]-2,4-dihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of N-acetyl-9-O-lactylneuraminic acid
Property Insights of N-acetyl-9-O-lactylneuraminic acid
The XLogP value of -3.1 indicates that N-acetyl-9-O-lactylneuraminic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 203.0 Ų indicates high polarity, suggesting N-acetyl-9-O-lactylneuraminic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-acetyl-9-O-lactylneuraminic acid has 7 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 N-acetyl-9-O-lactylneuraminic acid?
The CAS number of N-acetyl-9-O-lactylneuraminic acid is 65167-52-4.
What is the molecular formula of N-acetyl-9-O-lactylneuraminic acid?
The molecular formula of N-acetyl-9-O-lactylneuraminic acid is C14H23NO11.
What is the molecular weight of N-acetyl-9-O-lactylneuraminic acid?
The molecular weight of N-acetyl-9-O-lactylneuraminic acid is 381.13 g/mol.
Where can I buy N-acetyl-9-O-lactylneuraminic acid?
You can request a quote for N-acetyl-9-O-lactylneuraminic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-acetyl-9-O-lactylneuraminic acid?
Yes, KEHONG BIO provides custom synthesis services for N-acetyl-9-O-lactylneuraminic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.