芹菜苷
TL;DR: 芹菜苷 (CAS 26544-34-3) is a chemical compound with molecular formula C26H28O14 and molecular weight 564.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
芹菜苷
7-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one
Also Known As: apiin, Apioside, Apigenin-7-apioglucoside, Apiin (Standard), Apiin (11)
| Molecular Formula | C26H28O14 |
|---|---|
| Molecular Weight | 564.15 g/mol |
| LogP | -1.4852 |
| Topological Polar Surface Area | 228.97 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 564.1479 |
| Heavy Atoms | 40 |
| Complexity | 1407.0167 |
Chemical Identifiers
| CAS Number | 26544-34-3 |
|---|---|
| SMILES | C1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)O)O)CO)O)O)O)(CO)O |
Product Overview
芹菜苷 (CAS 26544-34-3), with molecular formula C26H28O14 and molecular weight 564.15 g/mol. IUPAC: 7-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one.
Chemical Property Profile of 芹菜苷
Property Insights of 芹菜苷
The XLogP value of -1.4852 indicates that 芹菜苷 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 228.97 Ų indicates high polarity, suggesting 芹菜苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 芹菜苷 has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 芹菜苷?
The CAS number of 芹菜苷 is 26544-34-3.
What is the molecular formula of 芹菜苷?
The molecular formula of 芹菜苷 is C26H28O14.
What is the molecular weight of 芹菜苷?
The molecular weight of 芹菜苷 is 564.15 g/mol.
Where can I buy 芹菜苷?
You can request a quote for 芹菜苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 芹菜苷?
Yes, KEHONG BIO provides custom synthesis services for 芹菜苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.