TL;DR: Fgagafl (CAS 121686-59-7) is a chemical compound with molecular formula C20H35NO15 and molecular weight 529.2007 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2R,3R,4R,5R)-5,6-dihydroxy-1-oxo-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexan-2-yl]acetamide
Also Known As: Fgagafl, N-[(2R,3R,4R,5R)-5,6-dihydroxy-1-oxo-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexan-2-yl]acetamide, O-Fucopyranosyl-(1-3)-O-galactopyranosyl-(1-4)-2-acetamido-2-deoxyglucopyranose (N-acetyl-3'-O-fucopyranosyllactosamine), O-fucopyranosyl-(1--3)-O-galactopyranosyl-(1--4)-2-acetamido-2-deoxyglucopyranose (N-acetyl-3'-O-fucopyranosyllactosamine), 6-Deoxy-alpha-L-galactopyranosyl-(1->4)-[alpha-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-D-glucose
| Molecular Formula | C20H35NO15 |
| Molecular Weight | 529.2007 g/mol |
| XLogP | -6.1 |
| Topological Polar Surface Area (TPSA) | 265.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 11 |
| Exact Mass | 529.2007 Da |
| Heavy Atoms | 36 |
| Complexity | 715.0 |
| SMILES | C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@H]([C@@H](CO)O)[C@@H]([C@H](C=O)NC(=O)C)O[C@@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)O)O)O |
| InChIKey | HHQLEBOUBWWITP-KPYHOPCKSA-N |
The XLogP value of -6.1 indicates that Fgagafl is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 265.0 Ų indicates high polarity, suggesting Fgagafl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Fgagafl has 10 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Fgagafl is 121686-59-7.
The molecular formula of Fgagafl is C20H35NO15.
The molecular weight of Fgagafl is 529.2007 g/mol.
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