Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside)
TL;DR: Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside) (CAS 129236-44-8) is a chemical compound with molecular formula C32H38O20 and molecular weight 742.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dihydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxychromen-4-one
Also Known As: QXRG, Quercetin 3-(2G-xylosylrutinoside), Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside), Quercetin 3-O-beta-(2(G)-O-beta-xylopyranosyl-6(G)-O-alpha-rhamnopyranosyl)glucopyranoside, 2-(3,4-dihydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxychromen-4-one
| Molecular Formula | C32H38O20 |
|---|---|
| Molecular Weight | 742.20 g/mol |
| LogP | -3.2238 |
| Topological Polar Surface Area | 328.35 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 8 |
| Exact Mass | 742.1956 |
| Heavy Atoms | 52 |
| Complexity | 1799.8032 |
Chemical Identifiers
| CAS Number | 129236-44-8 |
|---|---|
| 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)O)O[C@H]6[C@@H]([C@H]([C@@H](CO6)O)O)O)O)O)O)O)O |
Product Overview
Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside) (CAS 129236-44-8), with molecular formula C32H38O20 and molecular weight 742.20 g/mol. IUPAC: 2-(3,4-dihydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxychromen-4-one.
Chemical Property Profile of Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside)
Property Insights of Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside)
The XLogP value of -3.2238 indicates that Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 328.35 Ų indicates high polarity, suggesting Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside) has 12 hydrogen bond donor(s) and 20 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-O-(2G-beta-D-xylopyranosylrutinoside)?
The CAS number of Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside) is 129236-44-8.
What is the molecular formula of Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside)?
The molecular formula of Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside) is C32H38O20.
What is the molecular weight of Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside)?
The molecular weight of Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside) is 742.20 g/mol.
Where can I buy Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside)?
You can request a quote for Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside)?
Yes, KEHONG BIO provides custom synthesis services for Quercetin 3-O-(2G-beta-D-xylopyranosylrutinoside) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.