TPCN02790

Name Acoapetaludine A
Molecular Formula C23H31NO3
Molecular Weight 369.51
CAS Registry Number 2414250-96-5
SMILES C=C1C2CC3(C1O)C1CC4C5(C)CCC6OCC(C2=O)C3C64C1N(CC)C5
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum apetalum Whole plants 0.000270% Phytochemistry 167, 112111 (2019). 10.1016/j.phytochem.2019.112111
Properties
HBA 4 HBD 1
HeavyAtoms 27 AlogP 2.26
TPSA 49.77 RotatableBonds 1
FractionCSP3 0.87 Rings 7
AromaticRings 0 AliphaticRings 7