Limocitrol 3-glucoside
TL;DR: Limocitrol 3-glucoside (CAS 77133-42-7) is a chemical compound with molecular formula C24H26O14 and molecular weight 538.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-dimethoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Also Known As: Limocitrol 3-glucoside, 3-O-Glucosyllymocitrol, Limocitrol-beta-D-glucoside, 4H-1-Benzopyran-4-one, 3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-dimethoxy-, 3-[(beta-D-Glucopyranosyl)oxy]-4 ,5,7-trihydroxy-3 ,6,8-trimethoxyflavone
| Molecular Formula | C24H26O14 |
|---|---|
| Molecular Weight | 538.13 g/mol |
| LogP | -0.2187 |
| Topological Polar Surface Area | 217.97 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 538.13226 |
| Heavy Atoms | 38 |
| Complexity | 1397.5986 |
Chemical Identifiers
| CAS Number | 77133-42-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C(=C(C(=C3O2)OC)O)OC)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O |
Product Overview
Limocitrol 3-glucoside (CAS 77133-42-7), with molecular formula C24H26O14 and molecular weight 538.13 g/mol. IUPAC: 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-dimethoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Limocitrol 3-glucoside
Property Insights of Limocitrol 3-glucoside
The XLogP value of -0.2187 indicates that Limocitrol 3-glucoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 217.97 Ų indicates high polarity, suggesting Limocitrol 3-glucoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Limocitrol 3-glucoside has 7 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 Limocitrol 3-glucoside?
The CAS number of Limocitrol 3-glucoside is 77133-42-7.
What is the molecular formula of Limocitrol 3-glucoside?
The molecular formula of Limocitrol 3-glucoside is C24H26O14.
What is the molecular weight of Limocitrol 3-glucoside?
The molecular weight of Limocitrol 3-glucoside is 538.13 g/mol.
Where can I buy Limocitrol 3-glucoside?
You can request a quote for Limocitrol 3-glucoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Limocitrol 3-glucoside?
Yes, KEHONG BIO provides custom synthesis services for Limocitrol 3-glucoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.