Cas no 247082-57-1 (Buddledone B)

Buddledone B structure
Buddledone B structure
Product Name:Buddledone B
CAS No:247082-57-1
MF:C15H22O2
MW:234.333984851837
CID:6688300
Update Time:2024-03-02

Buddledone B Chemical and Physical Properties

Names and Identifiers

    • Buddledone B
    • Inchi: 1S/C15H22O2/c1-11-6-5-7-13(16)12(2)10-15(3,4)9-8-14(11)17/h8-11H,5-7H2,1-4H3/b9-8+,12-10-/t11-/m1/s1
    • InChI Key: NFDDZSDTJCSOCJ-PIEPLHKJSA-N
    • SMILES: C1C(C)(C)C=CC(=O)[C@H](C)CCCC(=O)C=1C |c:15,t:4,&1:8|

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • XLogP3: 3.052
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