Products 58997-12-9

CAS 58997-12-9 appears in our catalog under these names: 3,5,6-Trichloro-2-pyridinol beta-D-Glucuronide Sodium Salt, >95% (HPLC), 3,5,6-Trichloro-2-pyridinol beta-D-Glucuronide, >95% (HPLC), 3,5,6-Trichloro-2-pyridinol b-D-glucuronide. Offered by: TRC, Chemat. Available pack sizes: 10mg, 2,5mg, 5mg, 25mg, 2mg.

Structural formula: {0} (CAS {1})

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(3,5,6-trichloro-2-pyridinyl)oxy]oxane-2-carboxylic acid (CAS 58997-12-9) is a chemical compound with the molecular formula C11H10Cl3NO7 and a molecular weight of 374.6 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(3,5,6-trichloro-2-pyridinyl)oxy]oxane-2-carboxylic acid. InChIKey: XIPKXSPRDJUGPJ-DEGUGSHBSA-N.

Identity
Molecular formulaC11H10Cl3NO7
Molecular weight374.6 g/mol
IUPAC name(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(3,5,6-trichloro-2-pyridinyl)oxy]oxane-2-carboxylic acid
InChIKeyXIPKXSPRDJUGPJ-DEGUGSHBSA-N
SMILESC1=C(C(=NC(=C1Cl)Cl)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)Cl

Computed by PubChem (NCBI)