TPCN02441

Name Acoapetaludine B
Molecular Formula C24H39NO5
Molecular Weight 421.58
CAS Registry Number 2414250-97-6
SMILES CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(OC)(C(CC23)C14)C5C6O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum apetalum Whole plants 0.001286% Phytochemistry 167, 112111 (2019). 10.1016/j.phytochem.2019.112111
Properties
HBA 6 HBD 2
HeavyAtoms 30 AlogP 1.53
TPSA 71.39 RotatableBonds 5
FractionCSP3 1.00 Rings 6
AromaticRings 0 AliphaticRings 6