TL;DR: Cornuside (CAS 131189-57-6) is a chemical compound with molecular formula C24H30O14 and molecular weight 542.1636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2R,3S,4R)-3-ethenyl-4-[2-(3,4,5-trihydroxybenzoyl)oxyethyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate
Also Known As: Cornuside, comuside, Cornuside I, Cornuside-I, CORNUSIDE (REFERENCE GRADE)
| Molecular Formula | C24H30O14 |
| Molecular Weight | 542.1636 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 222.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 11 |
| Exact Mass | 542.1636 Da |
| Heavy Atoms | 38 |
| Complexity | 851.0 |
| SMILES | COC(=O)C1=CO[C@@H]([C@H]([C@H]1CCOC(=O)C2=CC(=C(C(=C2)O)O)O)C=C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O |
| InChIKey | SMTKSCGLXONVGL-ZEIULZLQSA-N |
The XLogP value of -0.2 indicates that Cornuside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 222.0 Ų indicates high polarity, suggesting Cornuside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cornuside has 7 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Cornuside is 131189-57-6.
The molecular formula of Cornuside is C24H30O14.
The molecular weight of Cornuside is 542.1636 g/mol.
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