Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside)
TL;DR: Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside) (CAS 128533-13-1) is a chemical compound with molecular formula C37H38O18 and molecular weight 770.2058 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4,5-dihydroxy-2-methyloxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
Also Known As: ICRG, Isorhamnetin-coumaroyl-Rha-Gal, [(2S,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4,5-dihydroxy-2-methyloxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate, Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside), Bicyclo[2.2.1]heptane,2,2-dimethoxy-1,7,7-trimethyl-,(1S)
Technical Specifications
| Molecular Formula | C37H38O18 |
| Molecular Weight | 770.2058 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 281.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 11 |
| Exact Mass | 770.2058 Da |
| Heavy Atoms | 55 |
| Complexity | 1380.0 |
| 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=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)O)O)O)O)O)OC(=O)/C=C/C6=CC=C(C=C6)O |
| InChIKey | BRALEKVBUFQYGS-HLYLUYEOSA-N |
Chemical Property Profile of Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside)
Property Insights of Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside)
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside). The TPSA of 281.0 Ų indicates high polarity, suggesting Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside) has 9 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside)?
The CAS number of Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside) is 128533-13-1.
What is the molecular formula of Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside)?
The molecular formula of Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside) is C37H38O18.
What is the molecular weight of Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside)?
The molecular weight of Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside) is 770.2058 g/mol.
Where can I buy Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside)?
You can request a quote for Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside)?
Yes, CoreyChem provides custom synthesis services for Isorhamnetin 3-O-beta-(4'''-4-coumaroyl-alpha-rhamnosyl(1-6)galactoside) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.