Isoferulic Acid 3-O-β-D-Glucuronide

For research use only. Not for therapeutic Use.

  • CAT Number: R054861
  • CAS Number: 1065272-10-7
  • Molecular Formula: C16H18O10
  • Molecular Weight: 370.31
  • Purity: ≥95%
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Catalog Number R054861
CAS Number 1065272-10-7
Synonyms

5-(2-Carboxyethenyl)-2-methoxyphenyl β-D-Glucopyranosiduronic Acid;

Molecular Formula C16H18O10
Purity ≥95%
Storage -20°C
IUPAC Name (2S,3S,4S,5R,6S)-6-[5-[(E)-2-carboxyethenyl]-2-methoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI InChI=1S/C16H18O10/c1-24-8-4-2-7(3-5-10(17)18)6-9(8)25-16-13(21)11(19)12(20)14(26-16)15(22)23/h2-6,11-14,16,19-21H,1H3,(H,17,18)(H,22,23)/b5-3+/t11-,12-,13+,14-,16+/m0/s1
InChIKey SHJZLGVIOYFHCB-MBAOVNHDSA-N
SMILES COC1=C(C=C(C=C1)C=CC(=O)O)OC2C(C(C(C(O2)C(=O)O)O)O)O

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