Products 102130-43-8

CAS 102130-43-8 appears in our catalog under these names: Atractyloside Dipotassium Salt, Atractyloside potassium salt/ 99.82% (existing batch purity), Atractyloside Dipotassium Salt, Atractyloside potassium salt 97%, Atractyloside (potassium salt) (Standard). Offered by: TRC, TargetMol, GLPBio, Biosynth, Ambeed. Available pack sizes: 10mg, 1mg, 2,5mg, 5mg, 25mg, 50mg, 100mg, 250mg.

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

Dipotassium;[(2S,3R,4R,5R,6R)-2-[[(1R,4R,5R,7R,9R,10S,13R,15S)-5-carboxy-15-hydroxy-9-methyl-14-methylidene-7-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]oxy]-6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-5-sulfonatooxyoxan-4-yl] sulfate (CAS 102130-43-8) is a chemical compound with the molecular formula C30H44K2O16S2 and a molecular weight of 803.0 g/mol. IUPAC name: dipotassium;[(2S,3R,4R,5R,6R)-2-[[(1R,4R,5R,7R,9R,10S,13R,15S)-5-carboxy-15-hydroxy-9-methyl-14-methylidene-7-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]oxy]-6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-5-sulfonatooxyoxan-4-yl] sulfate. InChIKey: IUCNQFHEWLYECJ-VCQILIGCSA-L.

Identity
Molecular formulaC30H44K2O16S2
Molecular weight803.0 g/mol
IUPAC namedipotassium;[(2S,3R,4R,5R,6R)-2-[[(1R,4R,5R,7R,9R,10S,13R,15S)-5-carboxy-15-hydroxy-9-methyl-14-methylidene-7-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]oxy]-6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-5-sulfonatooxyoxan-4-yl] sulfate
InChIKeyIUCNQFHEWLYECJ-VCQILIGCSA-L
SMILESCC(C)CC(=O)O[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1O[C@@H]2C[C@H]([C@H]3CC[C@@]45C[C@@H](CC[C@H]4[C@@]3(C2)C)C(=C)[C@@H]5O)C(=O)O)CO)OS(=O)(=O)[O-])OS(=O)(=O)[O-].[K+].[K+]

Computed by PubChem (NCBI)