CAS: 102130-43-8 | Atractyloside dipotassium salt, NX11473

SKU: NX11473-25MG
CAS: 102130-43-8 | Atractyloside dipotassium salt, NX11473
CAS: 102130-43-8 | Atractyloside dipotassium salt, NX11473

CAS: 102130-43-8 | Atractyloside dipotassium salt, NX11473

SKU: NX11473-25MG
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Product Identifiers

Catalog # NX11473
CAS Number 102130-43-8
PubChem CID 12299879
Chemical Name Atractyloside dipotassium salt
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
InChI InChI=1S/C30H46O16S2.2K/c1-14(2)9-22(32)44-25-24(46-48(39,40)41)23(45-47(36,37)38)20(13-31)43-28(25)42-17-10-18(27(34)35)19-7-8-30-11-16(15(3)26(30)33)5-6-21(30)29(19,4)12-17;;/h14,16-21,23-26,28,31,33H,3,5-13H2,1-2,4H3,(H,34,35)(H,36,37,38)(H,39,40,41);;/q;2*+1/p-2/t16-,17-,18-,19-,20-,21+,23-,24+,25-,26+,28+,29-,30-;;/m1../s1
InChIKey IUCNQFHEWLYECJ-VCQILIGCSA-L
SMILES [K+].[K+].CC(C)CC(=O)O[C@H]1[C@@H](O[C@@H]2C[C@H]([C@H]3CC[C@@]45C[C@@H](CC[C@H]4[C@]3(C)C2)C(=C)[C@@H]5O)C(=O)O)O[C@H](CO)[C@@H](OS(=O)(=O)[O-])[C@@H]1OS(=O)(=O)[O-]
MDL Number MFCD00078810

Specification

MW 803
MF C30H44K2O16S2
Manufacturer Apollo Scientific
Country of Origin United Kingdom

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