lacto-N-fucoheptaose
TL;DR: lacto-N-fucoheptaose (CAS 1240020-24-9) is a chemical compound with molecular formula C46H78N2O35 and molecular weight 1218.4385 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-[2-[[3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-(1,2,4,5-tetrahydroxy-6-oxohexan-3-yl)oxyoxan-4-yl]oxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl]acetamide
Also Known As: Lacto-N-fucoheptaose, MFLNH II, Monofucosyllacto-N-hexaose II, Lewis a heptasaccharide branched, N-[2-[2-[[3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-(1,2,4,5-tetrahydroxy-6-oxohexan-3-yl)oxyoxan-4-yl]oxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl]acetamide
Technical Specifications
| Molecular Formula | C46H78N2O35 |
| Molecular Weight | 1218.4385 g/mol |
| XLogP | -13.9 |
| Topological Polar Surface Area (TPSA) | 591.0 Ų |
| Hydrogen Bond Donors | 22 |
| Hydrogen Bond Acceptors | 35 |
| Rotatable Bonds | 24 |
| Exact Mass | 1218.4385 Da |
| Heavy Atoms | 83 |
| Complexity | 2050.0 |
| SMILES | CC1C(C(C(C(O1)OC2(CC(C(OC2CO)OC3C(C(OC(C3O)OC(C(CO)O)C(C(C=O)O)O)COC4C(C(C(C(O4)CO)OC5C(C(C(C(O5)CO)O)O)O)O)NC(=O)C)O)NC(=O)C)OC6C(C(C(C(O6)CO)O)O)O)O)O)O |
| InChIKey | DUUXDOCGEHMZIH-UHFFFAOYSA-N |
Chemical Property Profile of lacto-N-fucoheptaose
Property Insights of lacto-N-fucoheptaose
The XLogP value of -13.9 indicates that lacto-N-fucoheptaose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 591.0 Ų indicates high polarity, suggesting lacto-N-fucoheptaose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, lacto-N-fucoheptaose has 22 hydrogen bond donor(s) and 35 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of lacto-N-fucoheptaose?
The CAS number of lacto-N-fucoheptaose is 1240020-24-9.
What is the molecular formula of lacto-N-fucoheptaose?
The molecular formula of lacto-N-fucoheptaose is C46H78N2O35.
What is the molecular weight of lacto-N-fucoheptaose?
The molecular weight of lacto-N-fucoheptaose is 1218.4385 g/mol.
Where can I buy lacto-N-fucoheptaose?
You can request a quote for lacto-N-fucoheptaose directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for lacto-N-fucoheptaose?
Yes, CoreyChem provides custom synthesis services for lacto-N-fucoheptaose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.