1,2,3-Thiadiazole-5-Carboxaldoxime Glucuronide
[CAS# 80238-98-8]

Identification

• Name: 1,2,3-Thiadiazole-5-Carboxaldoxime Glucuronide
• Synonyms: (2S,3S,4S,5R)-3,4,5-Trihydroxy-6-(Thiadiazol-5-Ylmethyleneamino)Oxy-Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R)-3,4,5-Trihydroxy-6-(5-Thiadiazolylmethyleneamino)Oxy-2-Tetrahydropyrancarboxylic Acid; (2S,3S,4S,5R)-3,4,5-Trihydroxy-6-(1,2,3-Thiadiazol-5-Ylmethylideneamino)Oxy-Oxane-2-Carboxylic Acid
• Molecular Formula: C₉H₁₁N₃O₇S
• Molecular Weight: 305.26
• CAS Registry Number: 80238-98-8
• SMILES: [C@@H]2(OC(O\N=C\C1=CN=NS1)[C@H](O)[C@@H](O)[C@@H]2O)C(=O)O
• InChI: 1S/C9H11N3O7S/c13-4-5(14)7(8(16)17)18-9(6(4)15)19-11-2-3-1-10-12-20-3/h1-2,4-7,9,13-15H,(H,16,17)/b11-2+/t4-,5-,6+,7-,9?/m0/s1
• InChIKey: OHHZWRSVFFNHLE-IXTFCTQBSA-N

Properties

• Density: 2.054g/cm³ (Cal.)
• Boiling point: 619.715°C at 760 mmHg (Cal.)
• Flash point: 328.592°C (Cal.)