Auriculoside
TL;DR: Auriculoside (CAS 75871-96-4) is a chemical compound with molecular formula C22H26O10 and molecular weight 450.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(2S)-7-hydroxy-3,4-dihydro-2H-chromen-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Auriculoside, 7,3',5'-Trihydroxy-4'-methoxyflavan 3'-glucoside, J2.770.055A, (2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(2S)-7-hydroxy-3,4-dihydro-2H-chromen-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol, 7,3 ,5 -Trihydroxy-4 -methoxyflavan 3 -glucoside
| Molecular Formula | C22H26O10 |
|---|---|
| Molecular Weight | 450.15 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 450.1526 |
| Heavy Atoms | 32 |
| Complexity | 607.0 |
Chemical Identifiers
| CAS Number | 75871-96-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)[C@@H]3CCC4=C(O3)C=C(C=C4)O)O |
| InChIKey | IJMWYFHXJWRHQH-PSWNVJQFSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Auriculoside (CAS 75871-96-4), with molecular formula C22H26O10 and molecular weight 450.15 g/mol. IUPAC: (2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(2S)-7-hydroxy-3,4-dihydro-2H-chromen-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of Auriculoside
Property Insights of Auriculoside
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Auriculoside. The TPSA of 158.0 Ų indicates high polarity, suggesting Auriculoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Auriculoside has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Auriculoside?
The CAS number of Auriculoside is 75871-96-4.
What is the molecular formula of Auriculoside?
The molecular formula of Auriculoside is C22H26O10.
What is the molecular weight of Auriculoside?
The molecular weight of Auriculoside is 450.15 g/mol.
Where can I buy Auriculoside?
You can request a quote for Auriculoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Auriculoside?
Yes, KEHONG BIO provides custom synthesis services for Auriculoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.