Quercetin 3,4'-diglucoside
TL;DR: Quercetin 3,4'-diglucoside (CAS 29125-80-2) is a chemical compound with molecular formula C27H30O17 and molecular weight 626.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dihydroxy-2-[3-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Also Known As: Quercetin 3,4'-diglucoside, QUERCETIN DIHYDRATE(RG), quercetin 3,4'-O-diglucoside, Quercetin-3,4'-diglucoside, Quercetin-3,4-di-O-glucoside
| Molecular Formula | C27H30O17 |
|---|---|
| Molecular Weight | 626.15 g/mol |
| LogP | -3.0658 |
| Topological Polar Surface Area | 289.66 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 7 |
| Exact Mass | 626.1483 |
| Heavy Atoms | 44 |
| Complexity | 1553.607 |
Chemical Identifiers
| CAS Number | 29125-80-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O |
Product Overview
Quercetin 3,4'-diglucoside (CAS 29125-80-2), with molecular formula C27H30O17 and molecular weight 626.15 g/mol. IUPAC: 5,7-dihydroxy-2-[3-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Quercetin 3,4'-diglucoside
Property Insights of Quercetin 3,4'-diglucoside
The XLogP value of -3.0658 indicates that Quercetin 3,4'-diglucoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 289.66 Ų indicates high polarity, suggesting Quercetin 3,4'-diglucoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Quercetin 3,4'-diglucoside has 11 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Quercetin 3,4'-diglucoside?
The CAS number of Quercetin 3,4'-diglucoside is 29125-80-2.
What is the molecular formula of Quercetin 3,4'-diglucoside?
The molecular formula of Quercetin 3,4'-diglucoside is C27H30O17.
What is the molecular weight of Quercetin 3,4'-diglucoside?
The molecular weight of Quercetin 3,4'-diglucoside is 626.15 g/mol.
Where can I buy Quercetin 3,4'-diglucoside?
You can request a quote for Quercetin 3,4'-diglucoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quercetin 3,4'-diglucoside?
Yes, KEHONG BIO provides custom synthesis services for Quercetin 3,4'-diglucoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.