TL;DR: 3-Hydroxytyrosol 3-O-glucoside (CAS 142542-89-0) is a chemical compound with molecular formula C14H20O8 and molecular weight 316.1158 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R,4S,5S,6R)-2-[2-hydroxy-5-(2-hydroxyethyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Cimidahurinine, Osmanthuside F, Cimidahurinin, CIMIDAHURNINE, Cimidahurine
| Molecular Formula | C14H20O8 |
| Molecular Weight | 316.1158 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 140.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.1158 Da |
| Heavy Atoms | 22 |
| Complexity | 341.0 |
| SMILES | C1=CC(=C(C=C1CCO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O |
| InChIKey | QOGCASCQGJEYDO-RKQHYHRCSA-N |
The XLogP value of -1.3 indicates that 3-Hydroxytyrosol 3-O-glucoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.0 Ų indicates high polarity, suggesting 3-Hydroxytyrosol 3-O-glucoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Hydroxytyrosol 3-O-glucoside has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3-Hydroxytyrosol 3-O-glucoside is 142542-89-0.
The molecular formula of 3-Hydroxytyrosol 3-O-glucoside is C14H20O8.
The molecular weight of 3-Hydroxytyrosol 3-O-glucoside is 316.1158 g/mol.
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