TPCN03320

Name Neolinine
Molecular Formula C23H37NO6
Molecular Weight 423.55
CAS Registry Number 112515-37-4
SMILES CCN1CC2(CO)CCC(O)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum nagarum Roots 0.000200% Planta Med 2005; 71: 1073±1076 10.1055/s-2005-873135
Properties
HBA 7 HBD 4
HeavyAtoms 30 AlogP -0.15
TPSA 102.62 RotatableBonds 4
FractionCSP3 1.00 Rings 6
AromaticRings 0 AliphaticRings 6