TL;DR: Agelasphin 11 (CAS 152139-44-1) is a chemical compound with molecular formula C49H97NO10 and molecular weight 859.71124 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3,4-dihydroxy-16-methyl-1-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadecan-2-yl]-2-hydroxytetracosanamide
Also Known As: Agelasphin 11, N-[3,4-dihydroxy-16-methyl-1-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadecan-2-yl]-2-hydroxytetracosanamide, N-(1-((alpha-D-Galactopyranosyloxy)methyl)-2,3-dihydroxy-15-methylheptadecyl)-2-hydroxytetracosanamide, N-[1-(alpha-D-Galactopyranosyloxy)-3,4-dihydroxy-16-methyloctadecan-2-yl]-2-hydroxytetracosanimidic acid, N-[1-(Hexopyranosyloxy)-3,4-dihydroxy-16-methyloctadecan-2-yl]-2-hydroxytetracosanimidic acid
| Molecular Formula | C49H97NO10 |
| Molecular Weight | 859.71124 g/mol |
| XLogP | 14.5 |
| Topological Polar Surface Area (TPSA) | 189.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 42 |
| Exact Mass | 859.71124 Da |
| Heavy Atoms | 60 |
| Complexity | 961.0 |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCC(C(=O)NC(CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)C(C(CCCCCCCCCCCC(C)CC)O)O)O |
| InChIKey | CWDKQZNZOJUUBP-DPNOIICRSA-N |
The XLogP value of 14.5 indicates that Agelasphin 11 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 189.0 Ų indicates high polarity, suggesting Agelasphin 11 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Agelasphin 11 has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Agelasphin 11 is 152139-44-1.
The molecular formula of Agelasphin 11 is C49H97NO10.
The molecular weight of Agelasphin 11 is 859.71124 g/mol.
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