Bergaptol-O-glucopyranoside
TL;DR: Bergaptol-O-glucopyranoside (CAS 131625-68-8) is a chemical compound with molecular formula C17H16O9 and molecular weight 364.07944 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyfuro[3,2-g]chromen-7-one
Also Known As: Bergaptol-O-glucopyranoside, Bergaptol-beta-glucopyranoside, Bergaptol O-, A-D-glucopyranoside, Bergaptol O-beta-D-glucopyranoside
Technical Specifications
| Molecular Formula | C17H16O9 |
| Molecular Weight | 364.07944 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 139.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.07944 Da |
| Heavy Atoms | 26 |
| Complexity | 566.0 |
| SMILES | C1=CC(=O)OC2=CC3=C(C=CO3)C(=C21)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
| InChIKey | CVAHFYWRHVOEBA-AQFIFQLPSA-N |
Chemical Property Profile of Bergaptol-O-glucopyranoside
Property Insights of Bergaptol-O-glucopyranoside
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bergaptol-O-glucopyranoside. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bergaptol-O-glucopyranoside. Following Lipinski's Rule of Five, Bergaptol-O-glucopyranoside has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Bergaptol-O-glucopyranoside?
The CAS number of Bergaptol-O-glucopyranoside is 131625-68-8.
What is the molecular formula of Bergaptol-O-glucopyranoside?
The molecular formula of Bergaptol-O-glucopyranoside is C17H16O9.
What is the molecular weight of Bergaptol-O-glucopyranoside?
The molecular weight of Bergaptol-O-glucopyranoside is 364.07944 g/mol.
Where can I buy Bergaptol-O-glucopyranoside?
You can request a quote for Bergaptol-O-glucopyranoside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bergaptol-O-glucopyranoside?
Yes, CoreyChem provides custom synthesis services for Bergaptol-O-glucopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.