Methyl chlorogenate

For research use only. Not for therapeutic Use.

  • CAT Number: R065876
  • CAS Number: 29708-87-0
  • Molecular Formula: C17H20O9
  • Molecular Weight: 368.338
  • Purity: ≥95%
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Catalog Number R065876
CAS Number 29708-87-0
Molecular Formula C17H20O9
Purity ≥95%
Target Plants
Storage -20°C
IUPAC Name methyl (1S,3R,4R,5R)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexane-1-carboxylate
InChI InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/t12-,13-,15-,17+/m1/s1
InChIKey MZNIJRAPCCELQX-SMKXDYDZSA-N
SMILES COC(=O)C1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O)O

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