1-Thio-beta-D-Glucopyranose 1-[6-(methylthio)-N-(sulfooxy)hexanimidate]
[CAS 29611-01-6]

Identification

• Name: 1-Thio-beta-D-Glucopyranose 1-[6-(methylthio)-N-(sulfooxy)hexanimidate]
• Synonyms: [[6-Methylsulfanyl-1-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Sulfanyl-Hexylidene]Amino] Sulfate; [[6-(Methylthio)-1-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Thio]Hexylidene]Amino] Sulfate; [[6-(Methylthio)-1-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Thio]Hexylidene]Amino] Sulfate
• Molecular Formula: C₁₃H₂₄NO₉S₃
• Molecular Weight: 434.51
• CAS Registry Number: 29611-01-6
• SMILES: [C@H]1(O)[C@H](O)[C@H](O[C@@H](SC(=N/O[S]([O-])(=O)=O)/CCCCCSC)[C@@H]1O)CO
• InChI: 1S/C13H25NO9S3/c1-24-6-4-2-3-5-9(14-23-26(19,20)21)25-13-12(18)11(17)10(16)8(7-15)22-13/h8,10-13,15-18H,2-7H2,1H3,(H,19,20,21)/p-1/b14-9+/t8-,10-,11+,12-,13+/m1/s1
• InChIKey: MEFPHTVXBPLRLX-KHXSHCKASA-M