TL;DR: Narirutin (CAS 108815-81-2) is a chemical compound with molecular formula C27H32O14 and molecular weight 580.1792 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Also Known As: Narirutin, Isonaringin, Isonaringenin, Nairutin, (2S)-Narirutin
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C27H32O14 |
| Molecular Weight | 580.1792 g/mol |
| XLogP | -1.1 |
| Topological Polar Surface Area (TPSA) | 225.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 6 |
| Exact Mass | 580.1792 Da |
| Heavy Atoms | 41 |
| Complexity | 884.0 |
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC(=C4C(=O)C[C@H](OC4=C3)C5=CC=C(C=C5)O)O)O)O)O)O)O)O |
| InChIKey | HXTFHSYLYXVTHC-AJHDJQPGSA-N |
The XLogP value of -1.1 indicates that Narirutin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 225.0 Ų indicates high polarity, suggesting Narirutin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Narirutin has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Narirutin is 108815-81-2.
The molecular formula of Narirutin is C27H32O14.
The molecular weight of Narirutin is 580.1792 g/mol.
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