TPCN01934

Name Cnicothamnol
Molecular Formula C15H24O2
Molecular Weight 236.36
CAS Registry Number 70855-58-2
SMILES C=C(CO)C1CCC2(C)C(O)CC=C(C)C2C1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Saussurea lappa Roots 0.000046% Planta Med 84(5): 329-335.(2018) 10.1055/s-0043-120115
Properties
HBA 2 HBD 2
HeavyAtoms 17 AlogP 2.67
TPSA 40.46 RotatableBonds 2
FractionCSP3 0.73 Rings 2
AromaticRings 0 AliphaticRings 2