tetra-N-acetylchitotetraose
TL;DR: tetra-N-acetylchitotetraose (CAS 2706-65-2) is a chemical compound with molecular formula C32H54N4O21 and molecular weight 830.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R)-5-acetamido-3,4-bis[[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-1-hydroxy-6-oxohexan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Also Known As: Tetra-N-acetylchitotetraose, N,N,N-Tetraacetylchitotetraose, CHITOTETRAOSE,TETRA-N-ACETYL, N,N,N,N-Tetraacetyl chitotetraose, N,N',N'',N'''-Tetraacetylchitintetraose
| Molecular Formula | C32H54N4O21 |
|---|---|
| Molecular Weight | 830.33 g/mol |
| LogP | -9.331 |
| Topological Polar Surface Area | 391.15 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 18 |
| Exact Mass | 830.32806 |
| Heavy Atoms | 57 |
| Complexity | 1350.7192 |
Chemical Identifiers
| CAS Number | 2706-65-2 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H](C=O)NC(=O)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)NC(=O)C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)NC(=O)C)CO)O)O |
Product Overview
tetra-N-acetylchitotetraose (CAS 2706-65-2), with molecular formula C32H54N4O21 and molecular weight 830.33 g/mol. IUPAC: N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R)-5-acetamido-3,4-bis[[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-1-hydroxy-6-oxohexan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide.
Chemical Property Profile of tetra-N-acetylchitotetraose
Property Insights of tetra-N-acetylchitotetraose
The XLogP value of -9.331 indicates that tetra-N-acetylchitotetraose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 391.15 Ų indicates high polarity, suggesting tetra-N-acetylchitotetraose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, tetra-N-acetylchitotetraose has 14 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of tetra-N-acetylchitotetraose?
The CAS number of tetra-N-acetylchitotetraose is 2706-65-2.
What is the molecular formula of tetra-N-acetylchitotetraose?
The molecular formula of tetra-N-acetylchitotetraose is C32H54N4O21.
What is the molecular weight of tetra-N-acetylchitotetraose?
The molecular weight of tetra-N-acetylchitotetraose is 830.33 g/mol.
Where can I buy tetra-N-acetylchitotetraose?
You can request a quote for tetra-N-acetylchitotetraose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tetra-N-acetylchitotetraose?
Yes, KEHONG BIO provides custom synthesis services for tetra-N-acetylchitotetraose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.