Patulitrin
TL;DR: Patulitrin (CAS 19833-25-1) is a chemical compound with molecular formula C22H22O13 and molecular weight 494.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Also Known As: Patulitrin, Patuletin 7-glucoside, Patuletin 7-O-glucoside, Patuletin-7-O-glucoside, 6-Methoxyquercetin 7-glucoside
| Molecular Formula | C22H22O13 |
|---|---|
| Molecular Weight | 494.11 g/mol |
| LogP | -0.5303 |
| Topological Polar Surface Area | 219.74 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 5 |
| Exact Mass | 494.10605 |
| Heavy Atoms | 35 |
| Complexity | 1315.1735 |
Chemical Identifiers
| CAS Number | 19833-25-1 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1O)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
Product Overview
Patulitrin (CAS 19833-25-1), with molecular formula C22H22O13 and molecular weight 494.11 g/mol. IUPAC: 2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Patulitrin
Property Insights of Patulitrin
The XLogP value of -0.5303 indicates that Patulitrin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 219.74 Ų indicates high polarity, suggesting Patulitrin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Patulitrin has 8 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Patulitrin?
The CAS number of Patulitrin is 19833-25-1.
What is the molecular formula of Patulitrin?
The molecular formula of Patulitrin is C22H22O13.
What is the molecular weight of Patulitrin?
The molecular weight of Patulitrin is 494.11 g/mol.
Where can I buy Patulitrin?
You can request a quote for Patulitrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Patulitrin?
Yes, KEHONG BIO provides custom synthesis services for Patulitrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.