1-Thio-beta-D-Glucopyranose 1-(6-(Methylsulfinyl)-N-(Sulfooxy)Hexanimidate)
[CAS# 499-37-6]

Identification

• Name: 1-Thio-beta-D-Glucopyranose 1-(6-(Methylsulfinyl)-N-(Sulfooxy)Hexanimidate)
• Synonyms: [[6-Methylsulfinyl-1-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Sulfanyl-Hexylidene]Amino] Sulfate; [[6-Methylsulfinyl-1-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Thio]Hexylidene]Amino] Sulfate; [[6-Methylsulfinyl-1-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Thio]Hexylidene]Amino] Sulfate
• Molecular Formula: C₁₃H₂₄NO₁₀S₃
• Molecular Weight: 450.51
• CAS Registry Number: 499-37-6
• SMILES: [C@H]1(O)[C@H](O)[C@H](O[C@@H](SC(=N/O[S]([O-])(=O)=O)/CCCCC[S](=O)C)[C@@H]1O)CO
• InChI: 1S/C13H25NO10S3/c1-26(19)6-4-2-3-5-9(14-24-27(20,21)22)25-13-12(18)11(17)10(16)8(7-15)23-13/h8,10-13,15-18H,2-7H2,1H3,(H,20,21,22)/p-1/b14-9+/t8-,10-,11+,12-,13+,26?/m1/s1
• InChIKey: HUCGRJSHMZWRQQ-LPXZBHKBSA-M