(2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-[(2S,3S,4S,5R,6R)-2,3,5-Trihydroxy-6-(Hydroxymethyl)Oxan-4-Yl]Sulfanyloxane-3,4,5-Triol
[CAS# 159495-64-4]

Identification

• Name: (2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-[(2S,3S,4S,5R,6R)-2,3,5-Trihydroxy-6-(Hydroxymethyl)Oxan-4-Yl]Sulfanyloxane-3,4,5-Triol
• Synonyms: (2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-[(2S,3S,4S,5R,6R)-2,3,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-4-Yl]Sulfanyl-Tetrahydropyran-3,4,5-Triol; (2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-[[(2S,3S,4S,5R,6R)-2,3,5-Trihydroxy-6-(Hydroxymethyl)-4-Tetrahydropyranyl]Thio]Tetrahydropyran-3,4,5-Triol; (2R,3S,4S,5R,6R)-2-Methylol-6-[[(2S,3S,4S,5R,6R)-2,3,5-Trihydroxy-6-Methylol-Tetrahydropyran-4-Yl]Thio]Tetrahydropyran-3,4,5-Triol
• Molecular Formula: C₁₂H₂₂O₁₀S
• Molecular Weight: 358.36
• CAS Registry Number: 159495-64-4
• SMILES: [C@H]1([C@H]([C@H](O[C@@H]([C@H]1O)CO)O)O)S[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
• InChI: 1S/C12H22O10S/c13-1-3-5(15)7(17)8(18)12(22-3)23-10-6(16)4(2-14)21-11(20)9(10)19/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8-,9-,10+,11+,12-/m1/s1
• InChIKey: XRTVCRDMGYFFNB-NMCXEIBESA-N

Properties

• Density: 1.779g/cm³ (Cal.)
• Boiling point: 727.634°C at 760 mmHg (Cal.)
• Flash point: 393.859°C (Cal.)