Cas no 125675-14-1 (6alpha-Acetoxy,9beta,10beta-epoxie-(1beta,4alpha,5alpha,8alpha)-4-Hydroxy-9,11(13)-guaiadien-12,8-olide)

6alpha-Acetoxy,9beta,10beta-epoxie-(1beta,4alpha,5alpha,8alpha)-4-Hydroxy-9,11(13)-guaiadien-12,8-olide structure
125675-14-1 structure
Product Name:6alpha-Acetoxy,9beta,10beta-epoxie-(1beta,4alpha,5alpha,8alpha)-4-Hydroxy-9,11(13)-guaiadien-12,8-olide
CAS No:125675-14-1
MF:C17H22O6
MW:322.352985858917
CID:2058075
Update Time:2025-04-21

6alpha-Acetoxy,9beta,10beta-epoxie-(1beta,4alpha,5alpha,8alpha)-4-Hydroxy-9,11(13)-guaiadien-12,8-olide Chemical and Physical Properties

Names and Identifiers

    • 6alpha-Acetoxy,9beta,10beta-epoxie-(1beta,4alpha,5alpha,8alpha)-4-Hydroxy-9,11(13)-guaiadien-12,8-olide
    • Inchi: 1S/C17H22O6/c1-7-10-12(21-8(2)18)11-9(5-6-16(11,3)20)17(4)14(23-17)13(10)22-15(7)19/h9-14,20H,1,5-6H2,2-4H3
    • InChI Key: BJPVHFNXISJUHL-UHFFFAOYSA-N
    • SMILES: CC(OC1C2C(CCC2(O)C)C2(C(O2)C2OC(C(C12)=C)=O)C)=O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 23
  • XLogP3: 0.905

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