TL;DR: Supprescin A (CAS 143896-40-6) is a chemical compound with molecular formula C16H28N4O11 and molecular weight 452.17545 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]acetyl] (2S)-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-aminopropanoate
Also Known As: Supprescin A, Galnac-O-ser-ser-gly, N-Acetylgalactosamine-O-seryl-seryl-glycine, [2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]acetyl] (2S)-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-aminopropanoate, Glycine, N-(N-(O-(2-(acetylamino)-2-deoxy-alpha-D-galactopyranosyl)-L-seryl)-L-seryl)-
| Molecular Formula | C16H28N4O11 |
| Molecular Weight | 452.17545 g/mol |
| XLogP | -5.5 |
| Topological Polar Surface Area (TPSA) | 253.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 12 |
| Exact Mass | 452.17545 Da |
| Heavy Atoms | 31 |
| Complexity | 649.0 |
| SMILES | CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@@H]1OC[C@@H](C(=O)OC(=O)CNC(=O)[C@H](CO)N)N)CO)O)O |
| InChIKey | UOOOFBAWVAQTJK-VSSKVTDTSA-N |
The XLogP value of -5.5 indicates that Supprescin A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 253.0 Ų indicates high polarity, suggesting Supprescin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Supprescin A has 8 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Supprescin A is 143896-40-6.
The molecular formula of Supprescin A is C16H28N4O11.
The molecular weight of Supprescin A is 452.17545 g/mol.
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