TPCN03334

Name Denudatine
Molecular Formula C22H33NO2
Molecular Weight 343.51
CAS Registry Number 26166-37-0
SMILES C=C1C2CCC3(C1O)C1CC4C5(C)CCCC4(C1N(CC)C5)C3C2O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum nagarum Roots 0.000060% Planta Med 2005; 71: 1073±1076 10.1055/s-2005-873135
Properties
HBA 3 HBD 2
HeavyAtoms 25 AlogP 2.82
TPSA 43.70 RotatableBonds 1
FractionCSP3 0.91 Rings 7
AromaticRings 0 AliphaticRings 7