rhamnetin-3-O-neohesperidoside
TL;DR: rhamnetin-3-O-neohesperidoside (CAS 101331-17-3) is a chemical compound with molecular formula C28H32O16 and molecular weight 624.169 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2S,3S,4S,5R,6R)-3,4-dihydroxy-6-methoxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one
Also Known As: Eprovafen, Rhamnetin-3-O-neohesperidoside, Rhamnetin-O(3)-neohesperidoside, 2-Butanone, 4-(ethylthio)-3,4,4-trifluoro-, 1-Penten-3-one, 1,2-difluoro-1-(phenylthio)-
Technical Specifications
| Molecular Formula | C28H32O16 |
| Molecular Weight | 624.169 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 244.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 7 |
| Exact Mass | 624.169 Da |
| Heavy Atoms | 44 |
| Complexity | 1040.0 |
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC)OC3=C(OC4=CC(=CC(=C4C3=O)O)OC)C5=CC(=C(C=C5)O)O)O)O)O)O)O |
| InChIKey | BDQAVVLZKLFTIK-KCYUVNIVSA-N |
Chemical Property Profile of rhamnetin-3-O-neohesperidoside
Property Insights of rhamnetin-3-O-neohesperidoside
The XLogP value of -0.3 indicates that rhamnetin-3-O-neohesperidoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 244.0 Ų indicates high polarity, suggesting rhamnetin-3-O-neohesperidoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, rhamnetin-3-O-neohesperidoside has 8 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of rhamnetin-3-O-neohesperidoside?
The CAS number of rhamnetin-3-O-neohesperidoside is 101331-17-3.
What is the molecular formula of rhamnetin-3-O-neohesperidoside?
The molecular formula of rhamnetin-3-O-neohesperidoside is C28H32O16.
What is the molecular weight of rhamnetin-3-O-neohesperidoside?
The molecular weight of rhamnetin-3-O-neohesperidoside is 624.169 g/mol.
Where can I buy rhamnetin-3-O-neohesperidoside?
You can request a quote for rhamnetin-3-O-neohesperidoside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for rhamnetin-3-O-neohesperidoside?
Yes, CoreyChem provides custom synthesis services for rhamnetin-3-O-neohesperidoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.