Isomaltohexose
TL;DR: Isomaltohexose (CAS 103620-16-2) is a chemical compound with molecular formula C36H62O31 and molecular weight 990.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4R,5R)-2,3,4,5-tetrahydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
Also Known As: Isomaltohexose, Isomaltohexaose, (Glc a1-6)5-Glc, (2R,3S,4R,5R)-2,3,4,5-tetrahydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal, A-d-glucopyranosyl-(1->6)-
| Molecular Formula | C36H62O31 |
|---|---|
| Molecular Weight | 990.33 g/mol |
| LogP | -13.6 |
| Topological Polar Surface Area | 514.0 Ų |
| Hydrogen Bond Donors | 20 |
| Hydrogen Bond Acceptors | 31 |
| Rotatable Bonds | 20 |
| Exact Mass | 990.3275 |
| Heavy Atoms | 67 |
| Complexity | 1490.0 |
Chemical Identifiers
| CAS Number | 103620-16-2 |
|---|---|
| SMILES | C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)OC[C@@H]3[C@H]([C@@H]([C@H]([C@H](O3)OC[C@@H]4[C@H]([C@@H]([C@H]([C@H](O4)OC[C@@H]5[C@H]([C@@H]([C@H]([C@H](O5)OC[C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O |
| InChIKey | OITCGTKWORAONZ-UUCUGTBWSA-N |
Product Overview
Isomaltohexose (CAS 103620-16-2), with molecular formula C36H62O31 and molecular weight 990.33 g/mol. IUPAC: (2R,3S,4R,5R)-2,3,4,5-tetrahydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal.
Chemical Property Profile of Isomaltohexose
Property Insights of Isomaltohexose
The XLogP value of -13.6 indicates that Isomaltohexose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 514.0 Ų indicates high polarity, suggesting Isomaltohexose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isomaltohexose has 20 hydrogen bond donor(s) and 31 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isomaltohexose?
The CAS number of Isomaltohexose is 103620-16-2.
What is the molecular formula of Isomaltohexose?
The molecular formula of Isomaltohexose is C36H62O31.
What is the molecular weight of Isomaltohexose?
The molecular weight of Isomaltohexose is 990.33 g/mol.
Where can I buy Isomaltohexose?
You can request a quote for Isomaltohexose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isomaltohexose?
Yes, KEHONG BIO provides custom synthesis services for Isomaltohexose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.