Gentiabavarutinoside
TL;DR: Gentiabavarutinoside (CAS 61252-90-2) is a chemical compound with molecular formula C28H32O16 and molecular weight 624.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-[[6-(1,8-dihydroxy-6-methoxy-9-oxoxanthen-2-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4,5-dihydroxy-2-methyloxan-3-yl] acetate
Also Known As: Gentiabavarutinoside, GENTIABARARUTINOSIDE, [6-[[6-(1,8-dihydroxy-6-methoxy-9-oxoxanthen-2-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4,5-dihydroxy-2-methyloxan-3-yl] acetate, 1,8-Dihydroxy-6-methoxy-9-oxo-9H-xanthen-2-yl 6-O-(4-O-acetyl-6-deoxyhexopyranosyl)hexopyranoside
| Molecular Formula | C28H32O16 |
|---|---|
| Molecular Weight | 624.17 g/mol |
| LogP | -1.0327 |
| Topological Polar Surface Area | 244.27 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 7 |
| Exact Mass | 624.169 |
| Heavy Atoms | 44 |
| Complexity | 1587.6401 |
Chemical Identifiers
| CAS Number | 61252-90-2 |
|---|---|
| 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)OC(=O)C |
Product Overview
Gentiabavarutinoside (CAS 61252-90-2), with molecular formula C28H32O16 and molecular weight 624.17 g/mol. IUPAC: [6-[[6-(1,8-dihydroxy-6-methoxy-9-oxoxanthen-2-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4,5-dihydroxy-2-methyloxan-3-yl] acetate.
Chemical Property Profile of Gentiabavarutinoside
Property Insights of Gentiabavarutinoside
The XLogP value of -1.0327 indicates that Gentiabavarutinoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 244.27 Ų indicates high polarity, suggesting Gentiabavarutinoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Gentiabavarutinoside has 7 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Gentiabavarutinoside?
The CAS number of Gentiabavarutinoside is 61252-90-2.
What is the molecular formula of Gentiabavarutinoside?
The molecular formula of Gentiabavarutinoside is C28H32O16.
What is the molecular weight of Gentiabavarutinoside?
The molecular weight of Gentiabavarutinoside is 624.17 g/mol.
Where can I buy Gentiabavarutinoside?
You can request a quote for Gentiabavarutinoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Gentiabavarutinoside?
Yes, KEHONG BIO provides custom synthesis services for Gentiabavarutinoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.