Patrinoside
TL;DR: Patrinoside (CAS 53962-20-2) is a chemical compound with molecular formula C21H34O11 and molecular weight 462.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-hydroxy-7-(hydroxymethyl)-4-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl] 3-methylbutanoate
Also Known As: Patrinoside, [6-hydroxy-7-(hydroxymethyl)-4-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl] 3-methylbutanoate
| Molecular Formula | C21H34O11 |
|---|---|
| Molecular Weight | 462.21 g/mol |
| LogP | -1.7621 |
| Topological Polar Surface Area | 175.37 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 462.2101 |
| Heavy Atoms | 32 |
| Complexity | 666.13135 |
Chemical Identifiers
| CAS Number | 53962-20-2 |
|---|---|
| SMILES | CC(C)CC(=O)OC1C2C(CC(C2CO)O)C(=CO1)COC3C(C(C(C(O3)CO)O)O)O |
Product Overview
Patrinoside (CAS 53962-20-2), with molecular formula C21H34O11 and molecular weight 462.21 g/mol. IUPAC: [6-hydroxy-7-(hydroxymethyl)-4-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl] 3-methylbutanoate.
Chemical Property Profile of Patrinoside
Property Insights of Patrinoside
The XLogP value of -1.7621 indicates that Patrinoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 175.37 Ų indicates high polarity, suggesting Patrinoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Patrinoside has 6 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 Patrinoside?
The CAS number of Patrinoside is 53962-20-2.
What is the molecular formula of Patrinoside?
The molecular formula of Patrinoside is C21H34O11.
What is the molecular weight of Patrinoside?
The molecular weight of Patrinoside is 462.21 g/mol.
Where can I buy Patrinoside?
You can request a quote for Patrinoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Patrinoside?
Yes, KEHONG BIO provides custom synthesis services for Patrinoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.