(4-Formyl-5-Hydroxy-6-Methylpyridin-3-Yl)Methyl [(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl] Hydrogen Phosphate
[CAS 77172-69-1]

Identification

• Name: (4-Formyl-5-Hydroxy-6-Methylpyridin-3-Yl)Methyl [(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl] Hydrogen Phosphate
• Synonyms: (4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methyl [(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl] Hydrogen Phosphate; (4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methyl [(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl] Hydrogen Phosphate; (4-Formyl-5-Hydroxy-6-Methyl-3-Pyridyl)Methyl [(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl] Hydrogen Phosphate
• Molecular Formula: C₁₄H₂₀NO₁₁P
• Molecular Weight: 409.29
• CAS Registry Number: 77172-69-1
• SMILES: [C@@H]1([C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)O[P](=O)(OCC2=C(C(=C(N=C2)C)O)C=O)O
• InChI: 1S/C14H20NO11P/c1-6-10(18)8(3-16)7(2-15-6)5-24-27(22,23)26-14-13(21)12(20)11(19)9(4-17)25-14/h2-3,9,11-14,17-21H,4-5H2,1H3,(H,22,23)/t9-,11-,12+,13-,14+/m1/s1
• InChIKey: JQSBWFKSSMLCOB-LPUQOGTASA-N