Sodium [(2S,3S,4S,5S,6R)-4-Hydroxy-6-Methoxy-2-Methyl-5-[(2S,3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyloxan-2-Yl]Oxyoxan-3-Yl] Sulfate
[CAS# 131511-45-0]

Identification

• Name: Sodium [(2S,3S,4S,5S,6R)-4-Hydroxy-6-Methoxy-2-Methyl-5-[(2S,3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyloxan-2-Yl]Oxyoxan-3-Yl] Sulfate
• Synonyms: Sodium [(2S,3S,4S,5S,6R)-4-Hydroxy-6-Methoxy-2-Methyl-5-[(2S,3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-3-Yl] Sulfate; Sodium [(2S,3S,4S,5S,6R)-4-Hydroxy-6-Methoxy-2-Methyl-5-[[(2S,3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-3-Tetrahydropyranyl] Sulfate; Sodium [(2S,3S,4S,5S,6R)-4-Hydroxy-6-Methoxy-2-Methyl-5-[(2S,3S,4R,5S,6S)-3,4,5-Trihydroxy-6-Methyl-Oxan-2-Yl]Oxy-Oxan-3-Yl] Sulfate
• Molecular Formula: C₁₃H₂₃NaO₁₂S
• Molecular Weight: 426.37
• CAS Registry Number: 131511-45-0
• SMILES: [C@@H]2(O[C@H]1[C@H](O)[C@H](O[S]([O-])(=O)=O)[C@@H](O[C@H]1OC)C)O[C@H]([C@@H](O)[C@@H](O)[C@@H]2O)C.[Na+]
• InChI: 1S/C13H24O12S.Na/c1-4-6(14)7(15)8(16)12(22-4)24-11-9(17)10(25-26(18,19)20)5(2)23-13(11)21-3;/h4-17H,1-3H3,(H,18,19,20);/q;+1/p-1/t4-,5-,6+,7+,8-,9+,10+,11-,12-,13+;/m0./s1
• InChIKey: QGWHFIMOCSNNNA-LOUHMKPMSA-M