(2R,3S,4S,5R,6R)-6-[(2R,3R,4R,5S,6R)-3-Acetamido-2-Hydroxy-6-(Hydroxymethyl)-5-Sulfonatooxy-Oxan-4-Yl]Oxy-3,4,5-Trihydroxy-Oxane-2-Carboxylate
[CAS# 11120-35-7]

Identification

• Name: (2R,3S,4S,5R,6R)-6-[(2R,3R,4R,5S,6R)-3-Acetamido-2-Hydroxy-6-(Hydroxymethyl)-5-Sulfonatooxy-Oxan-4-Yl]Oxy-3,4,5-Trihydroxy-Oxane-2-Carboxylate
• Synonyms: (2R,3S,4S,5R,6R)-6-[(2R,3R,4R,5R,6R)-3-Acetamido-2-Hydroxy-6-(Hydroxymethyl)-5-Sulfonatooxy-Tetrahydropyran-4-Yl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylate; (2R,3S,4S,5R,6R)-6-[[(2R,3R,4R,5R,6R)-3-Acetamido-2-Hydroxy-6-(Hydroxymethyl)-5-Sulfonatooxy-4-Tetrahydropyranyl]Oxy]-3,4,5-Trihydroxy-2-Tetrahydropyrancarboxylate; (2R,3S,4S,5R,6R)-6-[(2R,3R,4R,5R,6R)-3-Acetamido-2-Hydroxy-6-Methylol-5-Sulfato-Tetrahydropyran-4-Yl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylate
• Molecular Formula: C₁₄H₂₁NO₁₅S
• Molecular Weight: 475.38
• CAS Registry Number: 11120-35-7
• SMILES: [C@H]2(O[C@@H]1O[C@H]([C@@H](O)[C@H](O)[C@H]1O)C([O-])=O)[C@@H](O[S]([O-])(=O)=O)[C@H](O[C@@H](O)[C@@H]2NC(=O)C)CO
• InChI: 1S/C14H23NO15S/c1-3(17)15-5-10(9(30-31(24,25)26)4(2-16)27-13(5)23)28-14-8(20)6(18)7(19)11(29-14)12(21)22/h4-11,13-14,16,18-20,23H,2H2,1H3,(H,15,17)(H,21,22)(H,24,25,26)/p-2/t4-,5-,6+,7+,8-,9+,10-,11-,13-,14-/m1/s1
• InChIKey: AVJBPWGFOQAPRH-FWMKGIEWSA-L