2,3-Dehydro-4-epi-N-acetylneuraminic acid
TL;DR: 2,3-Dehydro-4-epi-N-acetylneuraminic acid (CAS 79026-37-2) is a chemical compound with molecular formula C11H17NO8 and molecular weight 291.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4R)-3-acetamido-4-hydroxy-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid
Also Known As: Dheana, DANA, Bis(hydroxymethyl)durene, 2,3-Dehydro-4-epi-N-acetylneuraminic acid, D-glycero-D-talo-Non-2-enonic acid, 5-(acetylamino)-2,6-anhydro-3,5-dideoxy-
| Molecular Formula | C11H17NO8 |
|---|---|
| Molecular Weight | 291.10 g/mol |
| LogP | -2.5 |
| Topological Polar Surface Area | 157.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.09543 |
| Heavy Atoms | 20 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 79026-37-2 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@@H](C=C(O[C@H]1[C@@H]([C@@H](CO)O)O)C(=O)O)O |
| InChIKey | JINJZWSZQKHCIP-PKGQWCBFSA-N |
Product Overview
2,3-Dehydro-4-epi-N-acetylneuraminic acid (CAS 79026-37-2), with molecular formula C11H17NO8 and molecular weight 291.10 g/mol. IUPAC: (2R,3R,4R)-3-acetamido-4-hydroxy-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid.
Chemical Property Profile of 2,3-Dehydro-4-epi-N-acetylneuraminic acid
Property Insights of 2,3-Dehydro-4-epi-N-acetylneuraminic acid
The XLogP value of -2.5 indicates that 2,3-Dehydro-4-epi-N-acetylneuraminic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 157.0 Ų indicates high polarity, suggesting 2,3-Dehydro-4-epi-N-acetylneuraminic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,3-Dehydro-4-epi-N-acetylneuraminic acid has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3-Dehydro-4-epi-N-acetylneuraminic acid?
The CAS number of 2,3-Dehydro-4-epi-N-acetylneuraminic acid is 79026-37-2.
What is the molecular formula of 2,3-Dehydro-4-epi-N-acetylneuraminic acid?
The molecular formula of 2,3-Dehydro-4-epi-N-acetylneuraminic acid is C11H17NO8.
What is the molecular weight of 2,3-Dehydro-4-epi-N-acetylneuraminic acid?
The molecular weight of 2,3-Dehydro-4-epi-N-acetylneuraminic acid is 291.10 g/mol.
Where can I buy 2,3-Dehydro-4-epi-N-acetylneuraminic acid?
You can request a quote for 2,3-Dehydro-4-epi-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 2,3-Dehydro-4-epi-N-acetylneuraminic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dehydro-4-epi-N-acetylneuraminic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.