Description
2,6,16-Kauranetriol is a natural diterpenoid isolated from the herbs of Pteris cretica.
Synonyms
2,6,16-Kauranetriol
IUPAC Name
(1S,4S,9R,10S,13R,14S)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,9]hexadecane-3,7,14-triol
Molecular Formula
C20H34O3
Canonical SMILES
CC1(CC(CC2(C1C(CC34C2CCC(C3)C(C4)(C)O)O)C)O)C
InChI
InChI=1S/C20H34O3/c1-17(2)8-13(21)9-18(3)15-6-5-12-7-20(15,11-19(12,4)23)10-14(22)16(17)18/h12-16,21-23H,5-11H2,1-4H3/t12-,13?,14?,15-,16+,18-,19+,20+/m1/s1
InChIKey
MGTDZPRNONHJLG-QMVVIZBCSA-N
Boiling Point
456.0±45.0 °C(Predicted)
Density
1.15±0.1 g/cm3(Predicted)
pKa
14.80±0.70(Predicted)