Cas no 79421-65-1 (7beta-Acetoxy-trans-commun-saeure)

7beta-Acetoxy-trans-commun-saeure structure
79421-65-1 structure
Product Name:7beta-Acetoxy-trans-commun-saeure
CAS No:79421-65-1
MF:C22H32O4
MW:360.487087249756
CID:2034476
Update Time:2025-04-21

7beta-Acetoxy-trans-commun-saeure Chemical and Physical Properties

Names and Identifiers

    • 7beta-Acetoxy-trans-commun-saeure
    • Inchi： 1S/C22H32O4/c1-7-14(2)9-10-17-15(3)18(26-16(4)23)13-19-21(17,5)11-8-12-22(19,6)20(24)25/h7,9,17-19H,1,3,8,10-13H2,2,4-6H3,(H,24,25)/b14-9+/t17-,18+,19+,21+,22-/m0/s1
    • InChI Key： ZJXFDQVVYBKPMA-YJFYXXRUSA-N
    • SMILES： C1C[C@]2(C)[C@@H](C/C=C(\C)/C=C)C([C@H](OC(C)=O)C[C@H]2[C@@](C)(C(O)=O)C1)=C

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 26
  • XLogP3: 5.328

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