Isomaltosylfructoside
TL;DR: Isomaltosylfructoside (CAS 21291-36-1) is a chemical compound with molecular formula C18H32O16 and molecular weight 504.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]-6-(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-3,4,5-triol
Also Known As: Isomaltosylfructoside, Isomaltosucrose, Theanderose, alpha-Isomaltosyl beta-D-fructoside, (2S,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]-6-(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-3,4,5-triol
| Molecular Formula | C18H32O16 |
|---|---|
| Molecular Weight | 504.17 g/mol |
| LogP | -8.183 |
| Topological Polar Surface Area | 279.68 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 7 |
| Exact Mass | 504.16904 |
| Heavy Atoms | 34 |
| Complexity | 680.33887 |
Chemical Identifiers
| CAS Number | 21291-36-1 |
|---|---|
| SMILES | C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)[C@@]3([C@H]([C@@H]([C@H](O3)CO)O)O)CO)O)O)O)O |
Product Overview
Isomaltosylfructoside (CAS 21291-36-1), with molecular formula C18H32O16 and molecular weight 504.17 g/mol. IUPAC: (2S,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]-6-(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-3,4,5-triol.
Chemical Property Profile of Isomaltosylfructoside
Property Insights of Isomaltosylfructoside
The XLogP value of -8.183 indicates that Isomaltosylfructoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 279.68 Ų indicates high polarity, suggesting Isomaltosylfructoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isomaltosylfructoside has 12 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 Isomaltosylfructoside?
The CAS number of Isomaltosylfructoside is 21291-36-1.
What is the molecular formula of Isomaltosylfructoside?
The molecular formula of Isomaltosylfructoside is C18H32O16.
What is the molecular weight of Isomaltosylfructoside?
The molecular weight of Isomaltosylfructoside is 504.17 g/mol.
Where can I buy Isomaltosylfructoside?
You can request a quote for Isomaltosylfructoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isomaltosylfructoside?
Yes, KEHONG BIO provides custom synthesis services for Isomaltosylfructoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.