Iriflophenone-3-C-beta-flucoside
TL;DR: Iriflophenone-3-C-beta-flucoside (CAS 114417-09-3) is a chemical compound with molecular formula C19H20O10 and molecular weight 408.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxyphenyl)-[2,4,6-trihydroxy-3-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl]methanone
Also Known As: Iriflophenone 3-C-glucoside, Iriflophenone 3-C-beta-D-glucopyranoside, Iriflophenone-3-C-beta-flucoside, Iriflophenone 3-C-b-D-glucopyranoside, MEGxp0_001276
| Molecular Formula | C19H20O10 |
|---|---|
| Molecular Weight | 408.11 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 188.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.10565 |
| Heavy Atoms | 29 |
| Complexity | 565.0 |
Chemical Identifiers
| CAS Number | 114417-09-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=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 | BZYKNVLTMWYEFA-ZJKJAXBQSA-N |
Product Overview
Iriflophenone-3-C-beta-flucoside (CAS 114417-09-3), with molecular formula C19H20O10 and molecular weight 408.11 g/mol. IUPAC: (4-hydroxyphenyl)-[2,4,6-trihydroxy-3-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl]methanone.
Chemical Property Profile of Iriflophenone-3-C-beta-flucoside
Property Insights of Iriflophenone-3-C-beta-flucoside
The XLogP value of -0.1 indicates that Iriflophenone-3-C-beta-flucoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 188.0 Ų indicates high polarity, suggesting Iriflophenone-3-C-beta-flucoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Iriflophenone-3-C-beta-flucoside has 8 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 Iriflophenone-3-C-beta-flucoside?
The CAS number of Iriflophenone-3-C-beta-flucoside is 114417-09-3.
What is the molecular formula of Iriflophenone-3-C-beta-flucoside?
The molecular formula of Iriflophenone-3-C-beta-flucoside is C19H20O10.
What is the molecular weight of Iriflophenone-3-C-beta-flucoside?
The molecular weight of Iriflophenone-3-C-beta-flucoside is 408.11 g/mol.
Where can I buy Iriflophenone-3-C-beta-flucoside?
You can request a quote for Iriflophenone-3-C-beta-flucoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Iriflophenone-3-C-beta-flucoside?
Yes, KEHONG BIO provides custom synthesis services for Iriflophenone-3-C-beta-flucoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.