[(2R,3S,4R,5R)-4,5-Dihydroxy-2-(Hydroxymethyl)-6-[(2S,3R,4R)-1,3,4,5-Tetrahydroxypentan-2-Yl]Oxyoxan-3-Yl] Dihydrogen Phosphate
[CAS# 121496-69-3]

Identification

• Name: [(2R,3S,4R,5R)-4,5-Dihydroxy-2-(Hydroxymethyl)-6-[(2S,3R,4R)-1,3,4,5-Tetrahydroxypentan-2-Yl]Oxyoxan-3-Yl] Dihydrogen Phosphate
• Synonyms: [(2R,3S,4R,5R)-4,5-Dihydroxy-2-(Hydroxymethyl)-6-[(1S,2R,3R)-2,3,4-Trihydroxy-1-(Hydroxymethyl)Butoxy]Tetrahydropyran-3-Yl] Dihydrogen Phosphate; [(2R,3S,4R,5R)-4,5-Dihydroxy-2-(Hydroxymethyl)-6-[(1S,2R,3R)-2,3,4-Trihydroxy-1-(Hydroxymethyl)Butoxy]-3-Tetrahydropyranyl] Dihydrogen Phosphate; [(2R,3S,4R,5R)-4,5-Dihydroxy-2-Methylol-6-[(1S,2R,3R)-2,3,4-Trihydroxy-1-Methylol-Butoxy]Tetrahydropyran-3-Yl] Dihydrogen Phosphate
• Molecular Formula: C₁₁H₂₃O₁₃P
• Molecular Weight: 394.27
• CAS Registry Number: 121496-69-3
• SMILES: [C@@H](CO)(OC1[C@H](O)[C@@H](O)[C@@H]([C@H](O1)CO)O[P](=O)(O)O)[C@H](O)[C@H](O)CO
• InChI: 1S/C11H23O13P/c12-1-4(15)7(16)5(2-13)22-11-9(18)8(17)10(6(3-14)23-11)24-25(19,20)21/h4-18H,1-3H2,(H2,19,20,21)/t4-,5+,6-,7-,8-,9-,10-,11?/m1/s1
• InChIKey: JKRSKMAIGNQRNA-HYZGGICSSA-N

Properties

• Density: 1.81g/cm³ (Cal.)
• Boiling point: 847.904°C at 760 mmHg (Cal.)
• Flash point: 466.596°C (Cal.)