Disodium (2S,3S,4S,5R,6R)-6-[(2R,3R,4R,5R,6R)-5-Acetamido-2-(Hydroxymethyl)-6-Methoxy-3-Sulfonatooxyoxan-4-Yl]Oxy-3,4,5-Trihydroxyoxane-2-Carboxylate
[CAS# 128553-04-8]

Identification

• Name: Disodium (2S,3S,4S,5R,6R)-6-[(2R,3R,4R,5R,6R)-5-Acetamido-2-(Hydroxymethyl)-6-Methoxy-3-Sulfonatooxyoxan-4-Yl]Oxy-3,4,5-Trihydroxyoxane-2-Carboxylate
• Synonyms: Disodium (2S,3S,4S,5R,6R)-6-[(2R,3R,4R,5R,6R)-5-Acetamido-2-(Hydroxymethyl)-6-Methoxy-3-Sulfonatooxy-Tetrahydropyran-4-Yl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylate; Disodium (2S,3S,4S,5R,6R)-6-[[(2R,3R,4R,5R,6R)-5-Acetamido-2-(Hydroxymethyl)-6-Methoxy-3-Sulfonatooxy-4-Tetrahydropyranyl]Oxy]-3,4,5-Trihydroxy-2-Tetrahydropyrancarboxylate; Disodium (2S,3S,4S,5R,6R)-6-[(2R,3R,4R,5R,6R)-3-Acetamido-2-Methoxy-6-Methylol-5-Sulfato-Tetrahydropyran-4-Yl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylate
• Molecular Formula: C₁₅H₂₃NNa₂O₁₅S
• Molecular Weight: 535.38
• CAS Registry Number: 128553-04-8
• SMILES: [C@@H]2(O[C@H]1[C@@H](O[S]([O-])(=O)=O)[C@H](O[C@@H](OC)[C@@H]1NC(=O)C)CO)O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C([O-])=O.[Na+].[Na+]
• InChI: 1S/C15H25NO15S.2Na/c1-4(18)16-6-11(10(31-32(24,25)26)5(3-17)28-14(6)27-2)29-15-9(21)7(19)8(20)12(30-15)13(22)23;;/h5-12,14-15,17,19-21H,3H2,1-2H3,(H,16,18)(H,22,23)(H,24,25,26);;/q;2*+1/p-2/t5-,6-,7+,8+,9-,10+,11-,12+,14-,15-;;/m1../s1
• InChIKey: VFJHIBOVYWZXEM-ZFSBJESCSA-L