Gossypetin-3,8-O-diglucoside
TL;DR: Gossypetin-3,8-O-diglucoside (CAS 99224-13-2) is a chemical compound with molecular formula C27H30O18 and molecular weight 642.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,8-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one
Also Known As: Gossypetin-3,8-O-diglucoside, J2.430.618F, 3,8-Bis(beta-D-glucopyranosyloxy)-3 ,4 ,5,7-tetrahydroxyflavone, 2-(3,4-Dihydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-8-yl beta-D-glucopyranoside, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,8-bis({[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-4H-chromen-4-one
| Molecular Formula | C27H30O18 |
|---|---|
| Molecular Weight | 642.14 g/mol |
| LogP | -3.3602 |
| Topological Polar Surface Area | 309.89 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 7 |
| Exact Mass | 642.1432 |
| Heavy Atoms | 45 |
| Complexity | 1603.0676 |
Chemical Identifiers
| CAS Number | 99224-13-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C(=C(C=C3O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O |
Product Overview
Gossypetin-3,8-O-diglucoside (CAS 99224-13-2), with molecular formula C27H30O18 and molecular weight 642.14 g/mol. IUPAC: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,8-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one.
Chemical Property Profile of Gossypetin-3,8-O-diglucoside
Property Insights of Gossypetin-3,8-O-diglucoside
The XLogP value of -3.3602 indicates that Gossypetin-3,8-O-diglucoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 309.89 Ų indicates high polarity, suggesting Gossypetin-3,8-O-diglucoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Gossypetin-3,8-O-diglucoside has 12 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Gossypetin-3,8-O-diglucoside?
The CAS number of Gossypetin-3,8-O-diglucoside is 99224-13-2.
What is the molecular formula of Gossypetin-3,8-O-diglucoside?
The molecular formula of Gossypetin-3,8-O-diglucoside is C27H30O18.
What is the molecular weight of Gossypetin-3,8-O-diglucoside?
The molecular weight of Gossypetin-3,8-O-diglucoside is 642.14 g/mol.
Where can I buy Gossypetin-3,8-O-diglucoside?
You can request a quote for Gossypetin-3,8-O-diglucoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Gossypetin-3,8-O-diglucoside?
Yes, KEHONG BIO provides custom synthesis services for Gossypetin-3,8-O-diglucoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.