NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN
TL;DR: NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN (CAS 12009-08-4) is a chemical compound with molecular formula C52H88N2O40 and molecular weight 1380.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3S,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[(2S,3S,4S,5R,6R)-4-[(2R,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Also Known As: N-[(3S,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[(2S,3S,4S,5R,6R)-4-[(2R,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide, NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN, NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(6-1)MAN-(6,3-1)MAN, NAG-(4-1)NAG-(4-1)MAN-(6-1)MAN-(3-1)MAN-(3,3-1)MAN-(2-1)MAN-(4,6-1)MAN, NAG-(4-1)NAG-(4-1)MAN-(6-1)MAN-(6-1)MAN-(3,3-1)MAN-(2-1)MAN-(4,3-1)MAN
| Molecular Formula | C52H88N2O40 |
|---|---|
| Molecular Weight | 1380.49 g/mol |
| LogP | -17.4828 |
| Topological Polar Surface Area | 661.94 Ų |
| Hydrogen Bond Donors | 25 |
| Hydrogen Bond Acceptors | 40 |
| Rotatable Bonds | 24 |
| Exact Mass | 1380.4913 |
| Heavy Atoms | 94 |
| Complexity | 2346.43 |
Chemical Identifiers
| CAS Number | 12009-08-4 |
|---|---|
| SMILES | CC(=O)N[C@H]1CO[C@@H]([C@H]([C@@H]1O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)CO[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO[C@@H]5[C@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O[C@@H]6[C@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O)O[C@@H]7[C@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O[C@@H]8[C@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O)NC(=O)C)CO |
Product Overview
NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN (CAS 12009-08-4), with molecular formula C52H88N2O40 and molecular weight 1380.49 g/mol. IUPAC: N-[(3S,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[(2S,3S,4S,5R,6R)-4-[(2R,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide.
Chemical Property Profile of NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN
Property Insights of NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN
The XLogP value of -17.4828 indicates that NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 661.94 Ų indicates high polarity, suggesting NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN has 25 hydrogen bond donor(s) and 40 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN?
The CAS number of NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN is 12009-08-4.
What is the molecular formula of NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN?
The molecular formula of NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN is C52H88N2O40.
What is the molecular weight of NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN?
The molecular weight of NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN is 1380.49 g/mol.
Where can I buy NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN?
You can request a quote for NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN?
Yes, KEHONG BIO provides custom synthesis services for NAG-(4-1)NAG-(4-1)MAN-(3-1)MAN-(2-1)MAN-(3,6-1)MAN-(3-1)MAN-(6,6-1)MAN and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.