1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo-
TL;DR: 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo- (CAS 82850-45-1) is a chemical compound with molecular formula C24H20O13 and molecular weight 516.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-hydroxy-3-methyl-1,11-dioxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyisochromeno[6,7-b]chromene-10-carboxylic acid
Also Known As: 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo-, 12-hydroxy-3-methyl-1,11-dioxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyisochromeno[6,7-b]chromene-10-carboxylic acid, 12-hydroxy-3-methyl-1,11-dioxo-8-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxyisochromeno(6,7-b)chromene-10-carboxylic acid, 8-(beta-D-Glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo-1H,11H-pyrano[3,4-b]xanthene-10-carboxylic acid, RefChem:79622
| Molecular Formula | C24H20O13 |
|---|---|
| Molecular Weight | 516.09 g/mol |
| LogP | -0.05648 |
| Topological Polar Surface Area | 217.33 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 516.0904 |
| Heavy Atoms | 37 |
| Complexity | 1682.4934 |
Chemical Identifiers
| CAS Number | 82850-45-1 |
|---|---|
| SMILES | CC1=CC2=CC3=C(C(=C2C(=O)O1)O)C(=O)C4=C(C=C(C=C4O3)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C(=O)O |
Product Overview
1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo- (CAS 82850-45-1), with molecular formula C24H20O13 and molecular weight 516.09 g/mol. IUPAC: 12-hydroxy-3-methyl-1,11-dioxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyisochromeno[6,7-b]chromene-10-carboxylic acid.
Chemical Property Profile of 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo-
Property Insights of 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo-
The XLogP value of -0.05648 indicates that 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 217.33 Ų indicates high polarity, suggesting 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo- has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo-?
The CAS number of 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo- is 82850-45-1.
What is the molecular formula of 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo-?
The molecular formula of 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo- is C24H20O13.
What is the molecular weight of 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo-?
The molecular weight of 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo- is 516.09 g/mol.
Where can I buy 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo-?
You can request a quote for 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo-?
Yes, KEHONG BIO provides custom synthesis services for 1H,11H-Pyrano(3,4-b)xanthene-10-carboxylic acid, 8-(beta-D-glucopyranosyloxy)-12-hydroxy-3-methyl-1,11-dioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.