O-(Glucuronic Acid 2-Sulfate)-(1--4)-O-(2,5)-Anhydromannitol 6-Sulfate
[CAS# 98632-68-9]

Identification

• Name: O-(Glucuronic Acid 2-Sulfate)-(1--4)-O-(2,5)-Anhydromannitol 6-Sulfate
• Synonyms: 3,4-Dihydroxy-6-[4-Hydroxy-5-(Hydroxymethyl)-2-(Sulfooxymethyl)Tetrahydrofuran-3-Yl]Oxy-5-Sulfooxy-Tetrahydropyran-2-Carboxylic Acid; 3,4-Dihydroxy-6-[[4-Hydroxy-5-(Hydroxymethyl)-2-(Sulfooxymethyl)-3-Tetrahydrofuranyl]Oxy]-5-Sulfooxy-2-Tetrahydropyrancarb
• Molecular Formula: C₁₂H₂₀O₁₇S₂
• Molecular Weight: 500.40
• CAS Registry Number: 98632-68-9
• SMILES: C(C2C(OC1C(C(C(C(O1)C(O)=O)O)O)O[S](=O)(=O)O)C(C(O2)CO)O)O[S](=O)(=O)O
• InChI: 1S/C12H20O17S2/c13-1-3-5(14)8(4(26-3)2-25-30(19,20)21)27-12-10(29-31(22,23)24)7(16)6(15)9(28-12)11(17)18/h3-10,12-16H,1-2H2,(H,17,18)(H,19,20,21)(H,22,23,24)
• InChIKey: FAMLQSCGIQGDPV-UHFFFAOYSA-N

Properties

• Density: 2.061g/cm³ (Cal.)