pinoresinol glucose
TL;DR: pinoresinol glucose (CAS 69251-96-3) is a chemical compound with molecular formula C26H32O11 and molecular weight 520.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,5S,6R)-2-[4-[(3S,3aR,6S,6aR)-3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: pinoresinol glucose, Pinoresinol 4-O-glucoside, pinoresinol glucoside, Pinoresinol 4-glucoside, Pinoresinol 4-O-beta-D-glucopyranoside
| Molecular Formula | C26H32O11 |
|---|---|
| Molecular Weight | 520.19 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 157.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 520.19446 |
| Heavy Atoms | 37 |
| Complexity | 741.0 |
Chemical Identifiers
| CAS Number | 69251-96-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)[C@@H]2[C@H]3CO[C@@H]([C@H]3CO2)C4=CC(=C(C=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)OC)O |
| InChIKey | QLJNETOQFQXTLI-WMYFGKAISA-N |
Product Overview
pinoresinol glucose (CAS 69251-96-3), with molecular formula C26H32O11 and molecular weight 520.19 g/mol. IUPAC: (2S,3R,4S,5S,6R)-2-[4-[(3S,3aR,6S,6aR)-3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of pinoresinol glucose
Property Insights of pinoresinol glucose
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for pinoresinol glucose. The TPSA of 157.0 Ų indicates high polarity, suggesting pinoresinol glucose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, pinoresinol glucose has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of pinoresinol glucose?
The CAS number of pinoresinol glucose is 69251-96-3.
What is the molecular formula of pinoresinol glucose?
The molecular formula of pinoresinol glucose is C26H32O11.
What is the molecular weight of pinoresinol glucose?
The molecular weight of pinoresinol glucose is 520.19 g/mol.
Where can I buy pinoresinol glucose?
You can request a quote for pinoresinol glucose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for pinoresinol glucose?
Yes, KEHONG BIO provides custom synthesis services for pinoresinol glucose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.