TPCN03299

Name Karakomine
Molecular Formula C22H33NO3
Molecular Weight 359.51
CAS Registry Number 142768-81-8
SMILES CCN1CC2(C)CCC(O)C34C1C(CC23)C12CC(C(O)CC14)C(C)C2=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum nagarum Roots 0.000750% Planta Med 2005; 71: 1073±1076 10.1055/s-2005-873135
Properties
HBA 4 HBD 2
HeavyAtoms 26 AlogP 2.08
TPSA 60.77 RotatableBonds 1
FractionCSP3 0.95 Rings 6
AromaticRings 0 AliphaticRings 6