Lacto-N-fucopentaose I
TL;DR: Lacto-N-fucopentaose I (CAS 7578-25-8) is a chemical compound with molecular formula C32H55NO25 and molecular weight 853.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2R,3S,4R,5R)-6-hydroxy-1-oxo-2,4-bis[[(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]oxyhexan-3-yl]oxyoxan-3-yl]acetamide
Also Known As: Lacto-N-fucopentaose I, LNF-I, D-Glucose, O-6-deoxy-alpha-L-galactopyranosyl-(1-2)-O-beta-D-galactopyranosyl-(1-3)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-3)-O-beta-D-galactopyranosyl-(1-4)-, N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2R,3S,4R,5R)-6-hydroxy-1-oxo-2,4-bis[[(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]oxyhexan-3-yl]oxyoxan-3-yl]acetamide, N-((2R,3R,4R,5S,6R)-4,5-dihydroxy-2-(((2R,3S,4R,5R)-6-hydroxy-1-oxo-2,4-bis(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-(((2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)hexan-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)acetamide
| Molecular Formula | C32H55NO25 |
|---|---|
| Molecular Weight | 853.31 g/mol |
| LogP | -10.9106 |
| Topological Polar Surface Area | 423.46 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 25 |
| Rotatable Bonds | 17 |
| Exact Mass | 853.30634 |
| Heavy Atoms | 58 |
| Complexity | 1285.9292 |
Chemical Identifiers
| CAS Number | 7578-25-8 |
|---|---|
| SMILES | C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@H](CO)[C@H]([C@@H]([C@H](C=O)O[C@@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)NC(=O)C)O[C@@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O)O)O |
Product Overview
Lacto-N-fucopentaose I (CAS 7578-25-8), with molecular formula C32H55NO25 and molecular weight 853.31 g/mol. IUPAC: N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2R,3S,4R,5R)-6-hydroxy-1-oxo-2,4-bis[[(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]oxyhexan-3-yl]oxyoxan-3-yl]acetamide.
Chemical Property Profile of Lacto-N-fucopentaose I
Property Insights of Lacto-N-fucopentaose I
The XLogP value of -10.9106 indicates that Lacto-N-fucopentaose I is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 423.46 Ų indicates high polarity, suggesting Lacto-N-fucopentaose I may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Lacto-N-fucopentaose I has 16 hydrogen bond donor(s) and 25 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-fucopentaose I?
The CAS number of Lacto-N-fucopentaose I is 7578-25-8.
What is the molecular formula of Lacto-N-fucopentaose I?
The molecular formula of Lacto-N-fucopentaose I is C32H55NO25.
What is the molecular weight of Lacto-N-fucopentaose I?
The molecular weight of Lacto-N-fucopentaose I is 853.31 g/mol.
Where can I buy Lacto-N-fucopentaose I?
You can request a quote for Lacto-N-fucopentaose I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lacto-N-fucopentaose I?
Yes, KEHONG BIO provides custom synthesis services for Lacto-N-fucopentaose I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.