Desacetylgentiabavarutinoside
TL;DR: Desacetylgentiabavarutinoside (CAS 54244-36-9) is a chemical compound with molecular formula C26H30O15 and molecular weight 582.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,8-dihydroxy-6-methoxy-2-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxyxanthen-9-one
Also Known As: Desacetylgentiabavarutinoside, DESACTYLGENTIABAVARUTINOSIDE, 1,8-dihydroxy-6-methoxy-2-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxyxanthen-9-one, 1,8-Dihydroxy-6-methoxy-9-oxo-9H-xanthen-2-yl 6-O-(6-deoxyhexopyranosyl)hexopyranoside, 1,8-dihydroxy-6-methoxy-2-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyl-oxan-2-yl)oxymethyl]oxan-2-yl]oxy-xanthen-9-one
| Molecular Formula | C26H30O15 |
|---|---|
| Molecular Weight | 582.16 g/mol |
| LogP | -1.6035 |
| Topological Polar Surface Area | 238.2 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 6 |
| Exact Mass | 582.15845 |
| Heavy Atoms | 41 |
| Complexity | 1473.0209 |
Chemical Identifiers
| CAS Number | 54244-36-9 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(C4=C(C=C3)OC5=CC(=CC(=C5C4=O)O)OC)O)O)O)O)O)O)O |
Product Overview
Desacetylgentiabavarutinoside (CAS 54244-36-9), with molecular formula C26H30O15 and molecular weight 582.16 g/mol. IUPAC: 1,8-dihydroxy-6-methoxy-2-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxyxanthen-9-one.
Chemical Property Profile of Desacetylgentiabavarutinoside
Property Insights of Desacetylgentiabavarutinoside
The XLogP value of -1.6035 indicates that Desacetylgentiabavarutinoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 238.2 Ų indicates high polarity, suggesting Desacetylgentiabavarutinoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Desacetylgentiabavarutinoside has 8 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Desacetylgentiabavarutinoside?
The CAS number of Desacetylgentiabavarutinoside is 54244-36-9.
What is the molecular formula of Desacetylgentiabavarutinoside?
The molecular formula of Desacetylgentiabavarutinoside is C26H30O15.
What is the molecular weight of Desacetylgentiabavarutinoside?
The molecular weight of Desacetylgentiabavarutinoside is 582.16 g/mol.
Where can I buy Desacetylgentiabavarutinoside?
You can request a quote for Desacetylgentiabavarutinoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desacetylgentiabavarutinoside?
Yes, KEHONG BIO provides custom synthesis services for Desacetylgentiabavarutinoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.