alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate)
TL;DR: alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate) (CAS 70802-12-9) is a chemical compound with molecular formula C12H15NO7 and molecular weight 285.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4S,5R,6S)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl pyridine-3-carboxylate
Also Known As: Buchananine, starbld0026921, [(2R,3S,4S,5R,6S)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl pyridine-3-carboxylate, alpha-D-Glucopyranose 6-(3-pyridinecarboxylate), 6-O-(Pyridine-3-carbonyl)-alpha-D-glucopyranose
| Molecular Formula | C12H15NO7 |
|---|---|
| Molecular Weight | 285.08 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.08484 |
| Heavy Atoms | 20 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 70802-12-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O)O)O)O |
| InChIKey | ASJDJBXXEHTEBW-GPTQDWHKSA-N |
Product Overview
alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate) (CAS 70802-12-9), with molecular formula C12H15NO7 and molecular weight 285.08 g/mol. IUPAC: [(2R,3S,4S,5R,6S)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl pyridine-3-carboxylate.
Chemical Property Profile of alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate)
Property Insights of alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate)
The XLogP value of -2.0 indicates that alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate). Following Lipinski's Rule of Five, alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate) has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate)?
The CAS number of alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate) is 70802-12-9.
What is the molecular formula of alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate)?
The molecular formula of alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate) is C12H15NO7.
What is the molecular weight of alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate)?
The molecular weight of alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate) is 285.08 g/mol.
Where can I buy alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate)?
You can request a quote for alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate)?
Yes, KEHONG BIO provides custom synthesis services for alpha-D-Glucopyranose, 6-(3-pyridinecarboxylate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.