Sodium [(2R,3S,4R,5R,6R)-5-Acetamido-6-Methoxy-4-[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-3-[(3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyloxan-2-Yl]Oxyoxan-2-Yl]Methyl Sulfate
[CAS# 162330-32-7]

Identification

• Name: Sodium [(2R,3S,4R,5R,6R)-5-Acetamido-6-Methoxy-4-[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-3-[(3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyloxan-2-Yl]Oxyoxan-2-Yl]Methyl Sulfate
• Synonyms: Sodium [(2R,3S,4R,5R,6R)-5-Acetamido-6-Methoxy-4-[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-3-[(3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Methyl Sulfate; Sodium [(2R,3S,4R,5R,6R)-5-Acetamido-6-Methoxy-4-[[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-3-[[(3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Methyl Sulfate; Sodium [(2R,3S,4R,5R,6R)-5-Acetamido-6-Methoxy-4-[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-3-[(3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Methyl Sulfate
• Molecular Formula: C₂₁H₃₆NNaO₁₈S
• Molecular Weight: 645.56
• CAS Registry Number: 162330-32-7
• SMILES: [C@@H]3(O[C@H]2[C@H](OC1O[C@H]([C@@H](O)[C@@H](O)[C@@H]1O)C)[C@H](O[C@@H](OC)[C@@H]2NC(=O)C)CO[S]([O-])(=O)=O)O[C@@H]([C@H](O)[C@H](O)[C@H]3O)CO.[Na+]
• InChI: 1S/C21H37NO18S.Na/c1-6-11(25)13(27)15(29)20(36-6)39-17-9(5-35-41(31,32)33)38-19(34-3)10(22-7(2)24)18(17)40-21-16(30)14(28)12(26)8(4-23)37-21;/h6,8-21,23,25-30H,4-5H2,1-3H3,(H,22,24)(H,31,32,33);/q;+1/p-1/t6-,8+,9+,10+,11+,12-,13+,14-,15-,16+,17+,18+,19+,20?,21-;/m0./s1
• InChIKey: INIIUSWZEGQLNG-PBJYBBQPSA-M