Chemical Compound

atractyloside

CAS Registry Number 102130-43-8
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atractyloside chemical structure
Primary Record

atractyloside

In stock
1,356 g
Purity
99.5 %
CAS
102130-43-8

Compound Identifiers & Properties

CAS
102130-43-8
PubChem CID
146156250
SMILES
CC(C)CC(=O)OC1C(C(C(OC1OC2CC(C3CC[C@@]45CC(CCC4[C@@]3(C2)C)C(=C)C5O)C(=O)O)CO)OS(=O)(=O)[O-])OS(=O)(=O)[O-].[K+].[K+]
Canonical SMILES
C=C1C2CCC3[C@]4(C)CC(OC5OC(CO)C(OS(=O)(=O)[O-])C(OS(=O)(=O)[O-])C5OC(=O)CC(C)C)CC(C(=O)O)C4CC[C@]3(C2)C1O.[K+].[K+]

Names & Synonyms

  • atractyloside
  • Atractylin, potassium salt
  • Atractyloside (potassium salt)
  • Atractyloside potassium salt
  • CHEBI:177574
  • 102130-43-8
  • 17754-44-8
  • dipotassium;[2-[[(1R,9R)-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-sulonatooxyoxan-4-yl] sulate