Cas no 53060-60-9 ((1R,2S,4R,9R,10S,13R)-5,5,9-Trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-2-ol)

(1R,2S,4R,9R,10S,13R)-5,5,9-Trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-2-ol structure
53060-60-9 structure
Product Name:(1R,2S,4R,9R,10S,13R)-5,5,9-Trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-2-ol
CAS No:53060-60-9
MF:C20H32O
MW:288.467486381531
CID:382528
Update Time:2024-02-29

(1R,2S,4R,9R,10S,13R)-5,5,9-Trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-2-ol Chemical and Physical Properties

Names and Identifiers

    • Kaur-16-en-7-ol, (7b)-
    • CandolA
    • Kaur-16-en-7β-ol
    • Candol A
    • (1R,2S,4R,9R,10S,13R)-5,5,9-Trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-2-ol
    • Inchi: 1S/C20H32O/c1-13-11-20-12-14(13)6-7-15(20)19(4)9-5-8-18(2,3)16(19)10-17(20)21/h14-17,21H,1,5-12H2,2-4H3/t14-,15+,16-,17+,19+,20+/m1/s1
    • InChI Key: WJSZZAMAQPVPRJ-ODQAOENWSA-N
    • SMILES: O[C@H]1C[C@@H]2C(C)(C)CCC[C@@]2(C)[C@@H]2CC[C@H]3C(=C)C[C@]21C3

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 0
  • Complexity: 478
  • Topological Polar Surface Area: 20.2
  • XLogP3: 6.616
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