1,6-Anhydrolactose hexaacetate
TL;DR: 1,6-Anhydrolactose hexaacetate (CAS 25878-57-3) is a chemical compound with molecular formula C24H32O16 and molecular weight 576.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2S,3S,4R,5S)-3-acetyloxy-4-[(2R,3R,4R,5R,6R)-3,4,5-triacetyloxy-6-acetylperoxyoxan-2-yl]oxy-8-oxabicyclo[3.2.1]octan-2-yl] acetate
Also Known As: 1,6-Anhydrolactose hexaacetate, 1,6-Alha, 1,6-Anhydro-beta-D-lactose hexaacetate, [(1R,2S,3S,4R,5S)-3-acetyloxy-4-[(2R,3R,4R,5R,6R)-3,4,5-triacetyloxy-6-acetylperoxyoxan-2-yl]oxy-8-oxabicyclo[3.2.1]octan-2-yl] acetate, (1R,2S,3S,4R,5S)-3-(acetyloxy)-4-{[(2R,3R,4R,5R,6R)-3,4,5-tris(acetyloxy)-6-(acetylperoxy)oxan-2-yl]oxy}-8-oxabicyclo[3.2.1]octan-2-yl acetate
| Molecular Formula | C24H32O16 |
|---|---|
| Molecular Weight | 576.17 g/mol |
| LogP | -0.2316 |
| Topological Polar Surface Area | 194.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 9 |
| Exact Mass | 576.169 |
| Heavy Atoms | 40 |
| Complexity | 995.3608 |
Chemical Identifiers
| CAS Number | 25878-57-3 |
|---|---|
| SMILES | CC(=O)O[C@H]1[C@H]2CC[C@H](O2)[C@H]([C@@H]1OC(=O)C)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)OOC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
Product Overview
1,6-Anhydrolactose hexaacetate (CAS 25878-57-3), with molecular formula C24H32O16 and molecular weight 576.17 g/mol. IUPAC: [(1R,2S,3S,4R,5S)-3-acetyloxy-4-[(2R,3R,4R,5R,6R)-3,4,5-triacetyloxy-6-acetylperoxyoxan-2-yl]oxy-8-oxabicyclo[3.2.1]octan-2-yl] acetate.
Chemical Property Profile of 1,6-Anhydrolactose hexaacetate
Property Insights of 1,6-Anhydrolactose hexaacetate
The XLogP value of -0.2316 indicates that 1,6-Anhydrolactose hexaacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 194.72 Ų indicates high polarity, suggesting 1,6-Anhydrolactose hexaacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,6-Anhydrolactose hexaacetate has 0 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,6-Anhydrolactose hexaacetate?
The CAS number of 1,6-Anhydrolactose hexaacetate is 25878-57-3.
What is the molecular formula of 1,6-Anhydrolactose hexaacetate?
The molecular formula of 1,6-Anhydrolactose hexaacetate is C24H32O16.
What is the molecular weight of 1,6-Anhydrolactose hexaacetate?
The molecular weight of 1,6-Anhydrolactose hexaacetate is 576.17 g/mol.
Where can I buy 1,6-Anhydrolactose hexaacetate?
You can request a quote for 1,6-Anhydrolactose hexaacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Anhydrolactose hexaacetate?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Anhydrolactose hexaacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.