Benoxaprofen Glucuronide

For research use only. Not for therapeutic Use.

  • CAT Number: R059829
  • CAS Number: 67472-42-8
  • Molecular Formula: C22H20ClNO9
  • Molecular Weight: 477.85
  • Purity: ≥95%
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Catalog Number R059829
CAS Number 67472-42-8
Synonyms

1-[2-(4-Chlorophenyl)-α-methyl-5-benzoxazoleacetate]?β-D-Glucopyranuronic Acid;

Molecular Formula C22H20ClNO9
Purity ≥95%
Storage -20°C
IUPAC Name (2S,3S,4S,5R,6S)-6-[2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]propanoyloxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI InChI=1S/C22H20ClNO9/c1-9(21(30)33-22-17(27)15(25)16(26)18(32-22)20(28)29)11-4-7-14-13(8-11)24-19(31-14)10-2-5-12(23)6-3-10/h2-9,15-18,22,25-27H,1H3,(H,28,29)/t9?,15-,16-,17+,18-,22-/m0/s1
InChIKey FMHXTOVNUBYPFK-OLHZERTASA-N
SMILES CC(C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)Cl)C(=O)OC4C(C(C(C(O4)C(=O)O)O)O)O

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