TL;DR: Quinquangulin-6-glucoside (CAS 132922-82-8) is a chemical compound with molecular formula C22H24O10 and molecular weight 448.13693 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-hydroxy-8-methoxy-2,9-dimethyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzo[g]chromen-4-one
Also Known As: Quinquangulin-6-glucoside, Qqg-GP, J1.608.686J, 5-hydroxy-8-methoxy-2,9-dimethyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzo[g]chromen-4-one, 5-Hydroxy-8-methoxy-2,9-dimethyl-4-oxo-4H-naphtho[2,3-b]pyran-6-yl beta-D-glucopyranoside
| Molecular Formula | C22H24O10 |
| Molecular Weight | 448.13693 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 155.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 448.13693 Da |
| Heavy Atoms | 32 |
| Complexity | 728.0 |
| SMILES | CC1=CC(=O)C2=C(O1)C=C3C(=C(C=C(C3=C2O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC)C |
| InChIKey | LMHFPNXXSGHPCH-BZGGIJSCSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinquangulin-6-glucoside. The TPSA of 155.0 Ų indicates high polarity, suggesting Quinquangulin-6-glucoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Quinquangulin-6-glucoside has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Quinquangulin-6-glucoside is 132922-82-8.
The molecular formula of Quinquangulin-6-glucoside is C22H24O10.
The molecular weight of Quinquangulin-6-glucoside is 448.13693 g/mol.
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