Glunicate
[CAS# 80763-86-6]

Identification

• Name: Glunicate
• Synonyms: [(2S,3R,4R,5S)-3-(Pyridine-3-Carbonylamino)-2,5-Bis(Pyridine-3-Carbonyloxy)-6-(Pyridine-3-Carbonyloxymethyl)Tetrahydropyran-4-Yl] Pyridine-3-Carboxylate; 3-Pyridinecarboxylic Acid [(2S,3R,4R,5S)-2,5-Bis[Oxo-(3-Pyridyl)Methoxy]-6-[[Oxo-(3-Pyridyl)Methoxy]Methyl]-3-[[Oxo-(3-Pyridyl)Methyl]Amino]-4-Tetrahydropyranyl] Ester; Nicotinic Acid [(2S,3R,4R,5S)-3-(Pyridine-3-Carbonylamino)-2,5-Bis(Pyridine-3-Carbonyloxy)-6-(Pyridine-3-Carbonyloxymethyl)Tetrahydropyran-4-Yl] Ester
• Molecular Formula: C₃₆H₂₈N₆O₁₀
• Molecular Weight: 704.65
• CAS Registry Number: 80763-86-6
• SMILES: [C@@H]3(OC(=O)C1=CC=CN=C1)[C@@H](NC(=O)C2=CC=CN=C2)[C@@H](OC([C@H]3OC(=O)C4=CC=CN=C4)COC(=O)C5=CC=CN=C5)OC(=O)C6=CC=CN=C6
• InChI: 1S/C36H28N6O10/c43-31(22-6-1-11-37-16-22)42-28-30(51-34(46)25-9-4-14-40-19-25)29(50-33(45)24-8-3-13-39-18-24)27(21-48-32(44)23-7-2-12-38-17-23)49-36(28)52-35(47)26-10-5-15-41-20-26/h1-20,27-30,36H,21H2,(H,42,43)/t27?,28-,29-,30-,36+/m1/s1
• InChIKey: ZLNMZWDQJJAEAM-VRELJSORSA-N

Properties

• Density: 1.485g/cm³ (Cal.)
• Boiling point: 893.311°C at 760 mmHg (Cal.)
• Flash point: 494.057°C (Cal.)