Lacto-N-difucohexaose II
TL;DR: Lacto-N-difucohexaose II (CAS 6327-36-2) is a chemical compound with molecular formula C38H65NO29 and molecular weight 999.36 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,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3R,4R,5R)-1,2,5-trihydroxy-6-oxo-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexan-3-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide
Also Known As: Lacto-N-difucohexaose II, Lndfh-II, Lacto-N-difucohexose II, Lewis A hexaose, LNDFH II
| Molecular Formula | C38H65NO29 |
|---|---|
| Molecular Weight | 999.36 g/mol |
| LogP | -11.0 |
| Topological Polar Surface Area | 482.0 Ų |
| Hydrogen Bond Donors | 18 |
| Hydrogen Bond Acceptors | 29 |
| Rotatable Bonds | 19 |
| Exact Mass | 999.3642 |
| Heavy Atoms | 68 |
| Complexity | 1580.0 |
Chemical Identifiers
| CAS Number | 6327-36-2 |
|---|---|
| SMILES | C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)NC(=O)C)O[C@H]4[C@H]([C@H](O[C@H]([C@@H]4O)O[C@H]([C@@H](CO)O)[C@@H]([C@H](C=O)O)O[C@H]5[C@H]([C@@H]([C@@H]([C@@H](O5)C)O)O)O)CO)O)CO)O)O)O |
| InChIKey | QNSWVQWPVUZACH-XCVMNONQSA-N |
Product Overview
Lacto-N-difucohexaose II (CAS 6327-36-2), with molecular formula C38H65NO29 and molecular weight 999.36 g/mol. IUPAC: N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3R,4R,5R)-1,2,5-trihydroxy-6-oxo-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexan-3-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide.
Chemical Property Profile of Lacto-N-difucohexaose II
Property Insights of Lacto-N-difucohexaose II
The XLogP value of -11.0 indicates that Lacto-N-difucohexaose II is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 482.0 Ų indicates high polarity, suggesting Lacto-N-difucohexaose II may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Lacto-N-difucohexaose II has 18 hydrogen bond donor(s) and 29 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Lacto-N-difucohexaose II?
The CAS number of Lacto-N-difucohexaose II is 6327-36-2.
What is the molecular formula of Lacto-N-difucohexaose II?
The molecular formula of Lacto-N-difucohexaose II is C38H65NO29.
What is the molecular weight of Lacto-N-difucohexaose II?
The molecular weight of Lacto-N-difucohexaose II is 999.36 g/mol.
Where can I buy Lacto-N-difucohexaose II?
You can request a quote for Lacto-N-difucohexaose II directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lacto-N-difucohexaose II?
Yes, KEHONG BIO provides custom synthesis services for Lacto-N-difucohexaose II and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.