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HIT218683238
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HIT218683238
  • HIT ID:HIT218683238
  • Cas No:20267-92-9
  • Common Name:Hydroxylinderstrenolide
  • IUPAC:(4aS,8aS,9aS)-9a-hydroxy-3,8a-dimethyl-5-methylidene-2H,4H,4aH,5H,6H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one
    IUPAC:(4aS,8aS,9aS)-9a-hydroxy-3,8a-dimethyl-5-methylidene-2H,4H,4aH,5H,6H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one
  • InChI key:VMGUBSLDEXOUMH-GLQYFDAESA-N
  • Molecular Formula:C15H18O3
  • Molecular Weight:246.306
  • Hydrogen Bond Donor (HBD):
  • Hydrogen Bond Acceptor (HBA):
  • LogP:
  • SMILES:[H][C@@]12CC3=C(C)C(=O)O[C@@]3(O)C[C@@]1(C)C=CCC2=C
    SMILES:[H][C@@]12CC3=C(C)C(=O)O[C@@]3(O)C[C@@]1(C)C=CCC2=C
  • Hydroxylinderstrenolide is a naturally occurring small-molecule compound that can be isolated from Commiphora myrrha and Lindera aggregata, which is an ingredient in the traditional Chinese medicine pill Chaihu Shugan Wan against "stagnation of liver qi, distension of chest and hypochondria, indigestion, and acid eructation. Hydroxylinderstrenolide is of interest in natural product research, phytochemical analysis, and bioactivity screening due to its defined chemical structure and plant-derived origin.
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