Gemfibrozil 1-O-β-Glucuronide

For research use only. Not for therapeutic Use.

  • CAT Number: R006319
  • CAS Number: 91683-38-4
  • Molecular Formula: C21H30O9
  • Molecular Weight: 426.462
  • Purity: ≥95%
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Catalog Number R006319
CAS Number 91683-38-4
Synonyms

1-[5-(2,5-Dimethylphenoxy)-2,2-dimethylpentanoate] β-D-Glucopyranuroic Acid;?Gemfibrozil Glucuronide;

Molecular Formula C21H30O9
Purity ≥95%
Storage -20°C
IUPAC Name (2S,3S,4S,5R,6S)-6-[5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI InChI=1S/C21H30O9/c1-11-6-7-12(2)13(10-11)28-9-5-8-21(3,4)20(27)30-19-16(24)14(22)15(23)17(29-19)18(25)26/h6-7,10,14-17,19,22-24H,5,8-9H2,1-4H3,(H,25,26)/t14-,15-,16+,17-,19-/m0/s1
InChIKey CJMNXSKEVNPQOK-LVEJAMMSSA-N
SMILES CC1=CC(=C(C=C1)C)OCCCC(C)(C)C(=O)OC2C(C(C(C(O2)C(=O)O)O)O)O

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