(2R,3R,4S,5R,6S)-3,4,5-Trihydroxy-2-(Hydroxymethyl)-6-[C-(2-Hydroxy-2- Methyl-Propyl)-N-Sulfonatooxy-Carbonimidoyl]Sulfanyl-Oxane
[CAS# 28463-28-7]

Identification

• Name: (2R,3R,4S,5R,6S)-3,4,5-Trihydroxy-2-(Hydroxymethyl)-6-[C-(2-Hydroxy-2- Methyl-Propyl)-N-Sulfonatooxy-Carbonimidoyl]Sulfanyl-Oxane
• Synonyms: [[3-Hydroxy-3-Methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Sulfanyl-Butylidene]Amino] Sulfate; [[3-Hydroxy-3-Methyl-1-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Thio]Butylidene]Amino] Sulfate; [[3-Hydroxy-3-Methyl-1-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Thio]Butylidene]Amino] Sulfate
• Molecular Formula: C₁₁H₂₀NO₁₀S₂
• Molecular Weight: 390.40
• CAS Registry Number: 28463-28-7
• SMILES: [C@H]1(O)[C@H](O)[C@H](O[C@@H](SC(=N/O[S]([O-])(=O)=O)/CC(O)(C)C)[C@@H]1O)CO
• InChI: 1S/C11H21NO10S2/c1-11(2,17)3-6(12-22-24(18,19)20)23-10-9(16)8(15)7(14)5(4-13)21-10/h5,7-10,13-17H,3-4H2,1-2H3,(H,18,19,20)/p-1/b12-6+/t5-,7-,8+,9-,10+/m1/s1
• InChIKey: DYAQCRHEYVANDL-PGFQGKCASA-M