Isosalipurposide
TL;DR: Isosalipurposide (CAS 4547-85-7) is a chemical compound with molecular formula C21H22O10 and molecular weight 434.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2,4-dihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one
Also Known As: Isosalipurposide
| Molecular Formula | C21H22O10 |
|---|---|
| Molecular Weight | 434.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 177.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.1213 |
| Heavy Atoms | 31 |
| Complexity | 619.0 |
Chemical Identifiers
| CAS Number | 4547-85-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C=CC(=O)C2=C(C=C(C=C2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O |
| InChIKey | WQCWELFQKXIPCN-QNDFHXLGSA-N |
Product Overview
Isosalipurposide (CAS 4547-85-7), with molecular formula C21H22O10 and molecular weight 434.12 g/mol. IUPAC: 1-[2,4-dihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one.
Chemical Property Profile of Isosalipurposide
Property Insights of Isosalipurposide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isosalipurposide. The TPSA of 177.0 Ų indicates high polarity, suggesting Isosalipurposide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isosalipurposide has 7 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 Isosalipurposide?
The CAS number of Isosalipurposide is 4547-85-7.
What is the molecular formula of Isosalipurposide?
The molecular formula of Isosalipurposide is C21H22O10.
What is the molecular weight of Isosalipurposide?
The molecular weight of Isosalipurposide is 434.12 g/mol.
Where can I buy Isosalipurposide?
You can request a quote for Isosalipurposide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isosalipurposide?
Yes, KEHONG BIO provides custom synthesis services for Isosalipurposide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.