Chemical Compound

Paeonin A

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Paeonin A chemical structure
Primary Record

Paeonin A

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
70697899
SMILES
C[C@]12C[C@@]3([C@@H]4C[C@]1([C@@]4([C@@H](O2)O3)COC(=O)C5=CC=CC=C5)O[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)COC(=O)C7=CC=CC=C7)O)O)O)O
Canonical SMILES
C[C@@]12C[C@@]3(O)O[C@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@H](O)[C@H](O)[C@H]1O

Names & Synonyms

  • Paeonin A
  • CHEBI:66719
  • J1.868.032G
  • Q27135342
  • [(1S,2S,3R,5R,6R,8S)-3-{[(2S,3R,4S,5R,6R)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-2-yl]methyl benzoate
  • Benzoic acid (1R,2S,4R,5R,6S,8S)-1-(6-O-benzoyl-beta-D-galactopyranosyloxy)-4-hydroxy-2,8:4beta,8-diepoxypinane-9-yl ester